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

Systemtic Name: N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonyl)propanamide hydrochloride Openeye Name: 3-(benzenesulfonyl)-N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)propanamide hydrochloride CAS Name: 3-(benzenesulfonyl)-N-[3-(1-imidazolyl)propyl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)propanamide hydrochloride IUPAC Name: 3-(benzenesulfonyl)-N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)propanamide hydrochloride Traditional Name: 3-besyl-N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)propionamide hydrochloride Formula: C24H27ClN4O4S2 MolecularWeight: 535.07858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CCCN3C=CN=C3)C(=O)CCS(=O)(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CCCN3C=CN=C3)C(=O)CCS(=O)(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C24H26N4O4S2.ClH/c1-18-9-10-20(32-2)22-23(18)33-24(26-22)28(14-6-13-27-15-12-25-17-27)21(29)11-16-34(30,31)19-7-4-3-5-8-19;/h3-5,7-10,12,15,17H,6,11,13-14,16H2,1-2H3;1H