N-(1,3-benzothiazol-2-yl)-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide Openeye Name: 4-(benzenesulfonamidomethyl)-N-(1,3-benzothiazol-2-yl)cyclohexanecarboxamide CAS Name: 4-(benzenesulfonamidomethyl)-N-(1,3-benzothiazol-2-yl)-1-cyclohexanecarboxamide IUPAC Name: 4-(benzenesulfonamidomethyl)-N-(1,3-benzothiazol-2-yl)cyclohexane-1-carboxamide Traditional Name: 4-(benzenesulfonamidomethyl)-N-(1,3-benzothiazol-2-yl)cyclohexanecarboxamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNS(=O)(=O)C2=CC=CC=C2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(CCC1CNS(=O)(=O)C2=CC=CC=C2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H23N3O3S2/c25-20(24-21-23-18-8-4-5-9-19(18)28-21)16-12-10-15(11-13-16)14-22-29(26,27)17-6-2-1-3-7-17/h1-9,15-16,22H,10-14H2,(H,23,24,25)