N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-propanamide hydrochloride

Systemtic Name: N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-propanamide hydrochloride Openeye Name: N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-(p-tolylsulfanyl)propanamide hydrochloride CAS Name: N-[3-(1-imidazolyl)propyl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)thio]propanamide hydrochloride IUPAC Name: N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanylpropanamide hydrochloride Traditional Name: N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-(p-tolylthio)propionamide hydrochloride Formula: C25H29ClN4O2S2 MolecularWeight: 517.10636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)N(CCCN2C=CN=C2)C3=NC4=C(C=CC(=C4S3)C)OC.Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N(CCCN2C=CN=C2)C3=NC4=C(C=CC(=C4S3)C)OC.Cl

InChI

InChI=1S/C25H28N4O2S2.ClH/c1-18-5-8-20(9-6-18)32-16-11-22(30)29(14-4-13-28-15-12-26-17-28)25-27-23-21(31-3)10-7-19(2)24(23)33-25;/h5-10,12,15,17H,4,11,13-14,16H2,1-3H3;1H