N-[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide

Systemtic Name: N-[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide Openeye Name: N-phenyl-N-[4-[[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]methyl]thiazol-2-yl]acetamide CAS Name: N-[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]-2-thiazolyl]-N-phenylacetamide IUPAC Name: N-[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,3-thiazol-2-yl]-N-phenylacetamide Traditional Name: N-phenyl-N-[4-[(4-tosyl-1,4-diazepan-1-yl)methyl]thiazol-2-yl]acetamide Formula: C24H28N4O3S2 MolecularWeight: 484.63412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CSC(=N3)N(C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CSC(=N3)N(C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C24H28N4O3S2/c1-19-9-11-23(12-10-19)33(30,31)27-14-6-13-26(15-16-27)17-21-18-32-24(25-21)28(20(2)29)22-7-4-3-5-8-22/h3-5,7-12,18H,6,13-17H2,1-2H3