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benzamide, N-[3-(2-benzothiazolyl)phenyl]-4-[(dimethylamino)sulfonyl]-
SpectraBase Compound ID 2c9rbSUsoUW
InChI InChI=1S/C22H19N3O3S2/c1-25(2)30(27,28)18-12-10-15(11-13-18)21(26)23-17-7-5-6-16(14-17)22-24-19-8-3-4-9-20(19)29-22/h3-14H,1-2H3,(H,23,26)
InChIKey YGELDWRNLBVKIM-UHFFFAOYSA-N
Mol Weight 437.53 g/mol
Molecular Formula C22H19N3O3S2
Exact Mass 437.086784 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HWD5s6f6Sgm
Name Benzamide, N-[3-(2-benzothiazolyl)phenyl]-4-[(dimethylamino)sulfonyl]-
Comments Computed using HOSE algorithm
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Exact Mass 437.086783829 u
Formula C22H19N3O3S2
InChI InChI=1S/C22H19N3O3S2/c1-25(2)30(27,28)18-12-10-15(11-13-18)21(26)23-17-7-5-6-16(14-17)22-24-19-8-3-4-9-20(19)29-22/h3-14H,1-2H3,(H,23,26)
InChIKey YGELDWRNLBVKIM-UHFFFAOYSA-N
Molecular Weight 437.532 g/mol
SMILES N(C(C=1C=CC(S(N(C)C)(=O)=O)=CC1)=O)C=1C=C(C2=NC=3C=CC=CC3S2)C=CC1