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N-[[(3-Cyclohexylmethyl)amino]propyl]-2-[[(4-chlorophenyl)sulfonyl]amino]-1,3-thiazol-4-yl-acetamide hydrochloride
SpectraBase Compound ID L9i2fKMEhWJ
InChI InChI=1S/C21H29ClN4O3S2.ClH/c22-17-7-9-19(10-8-17)31(28,29)26-21-25-18(15-30-21)13-20(27)24-12-4-11-23-14-16-5-2-1-3-6-16;/h7-10,15-16,23H,1-6,11-14H2,(H,24,27)(H,25,26);1H
InChIKey JVYVWHBACFFFJO-UHFFFAOYSA-N
Mol Weight 521.52 g/mol
Molecular Formula C21H30Cl2N4O3S2
Exact Mass 520.113639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9I5qFjTpMIa
Name N-[[(3-Cyclohexylmethyl)amino]propyl]-2-[[(4-chlorophenyl)sulfonyl]amino]-1,3-thiazol-4-yl-acetamide hydrochloride
Alternate Name(s) 2-(2-(4-chlorophenylsulfonamido)thiazol-4-yl)-N-(3-((cyclohexylmethyl)amino)propyl)acetamide hydrochloride 2-[2-[(4-chlorophenyl)sulfonylamino]-4-thiazolyl]-N-[3-(cyclohexylmethylamino)propyl]acetamide;hydrochloride 2-[2-[(4-chlorophenyl)sulfonylamino]-1,3-thiazol-4-yl]-N-[3-(cyclohexylmethylamino)propyl]acetamide;hydrochloride 2-[2-[(4-chlorophenyl)sulfonylamino]-1,3-thiazol-4-yl]-N-[3-(cyclohexylmethylamino)propyl]ethanamide;hydrochloride
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Formula C21H30Cl2N4O3S2
InChI InChI=1S/C21H29ClN4O3S2.ClH/c22-17-7-9-19(10-8-17)31(28,29)26-21-25-18(15-30-21)13-20(27)24-12-4-11-23-14-16-5-2-1-3-6-16;/h7-10,15-16,23H,1-6,11-14H2,(H,24,27)(H,25,26);1H
InChIKey JVYVWHBACFFFJO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200700046
Molecular Weight 521.522 g/mol
SMILES N(S(c1ccc(cc1)Cl)(=O)=O)c1nc(CC(=O)NCCCNCC2CCCCC2)cs1.Cl
SPLASH splash10-0hii-8410900000-019614c610bd3bfa421f
Source of Spectrum APC-341-652-3n
Wiley ID 1768904