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1-[3'-Methylbenzthiazol-2'(3H)-on-6'-yl]-4-{4'-[2"-(2"',4"'-dichlorophenyl)-2'(1H-imidazol-1"-ylmethyl)-1',3'-dioxolan-4'-yl]methyleneoxy]phenyl}piperazine

View entire compound with spectra: 1 MS (GC)

1-[3'-Methylbenzthiazol-2'(3H)-on-6'-yl]-4-{4'-[2"-(2"',4"'-dichlorophenyl)-2'(1H-imidazol-1"-ylmethyl)-1',3'-dioxolan-4'-yl]methyleneoxy]phenyl}piperazine
SpectraBase Compound ID 3CMsSmA3DOe
InChI InChI=1S/C32H31Cl2N5O4S/c1-36-28-9-5-24(17-29(28)44-31(36)40)39-14-12-38(13-15-39)23-3-6-25(7-4-23)41-19-32(26-8-2-22(33)16-27(26)34)20-42-30(43-32)18-37-11-10-35-21-37/h2-11,16-17,21,30H,12-15,18-20H2,1H3
InChIKey ZNDKPMNDPIEEOX-UHFFFAOYSA-N
Mol Weight 652.6 g/mol
Molecular Formula C32H31Cl2N5O4S
Exact Mass 651.147381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D4t8Z6zoFsb
Name 1-[3'-Methylbenzthiazol-2'(3H)-on-6'-yl]-4-{4'-[2"-(2"',4"'-dichlorophenyl)-2'(1H-imidazol-1"-ylmethyl)-1',3'-dioxolan-4'-yl]methyleneoxy]phenyl}piperazine
Alternate Name(s) 6-[4-(4-{[4-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)-1-piperazinyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H31Cl2N5O4S
InChI InChI=1S/C32H31Cl2N5O4S/c1-36-28-9-5-24(17-29(28)44-31(36)40)39-14-12-38(13-15-39)23-3-6-25(7-4-23)41-19-32(26-8-2-22(33)16-27(26)34)20-42-30(43-32)18-37-11-10-35-21-37/h2-11,16-17,21,30H,12-15,18-20H2,1H3
InChIKey ZNDKPMNDPIEEOX-UHFFFAOYSA-N
Molecular Weight 652.597 g/mol
SMILES C1(N(c2ccc(N3CCN(CC3)c3ccc(OCC4(c5c(cc(cc5)Cl)Cl)OC(C[n]5cncc5)OC4)cc3)cc2S1)C)=O
SPLASH splash10-0udi-0002009000-fc4a15ba37c1c7a35083
Source of Spectrum Y-29-1074-13
Wiley ID 1413161