4-(4-chlorophenyl)-N-propyl-thieno[2,3-b][1,5]benzothiazepine-7-sulfonamide

Systemtic Name: 4-(4-chlorophenyl)-N-propyl-thieno[2,3-b][1,5]benzothiazepine-7-sulfonamide Openeye Name: 4-(4-chlorophenyl)-N-propyl-thieno[2,3-b][1,5]benzothiazepine-7-sulfonamide CAS Name: 4-(4-chlorophenyl)-N-propyl-7-thieno[2,3-b][1,5]benzothiazepinesulfonamide IUPAC Name: 4-(4-chlorophenyl)-N-propylthieno[2,3-b][1,5]benzothiazepine-7-sulfonamide Traditional Name: 4-(4-chlorophenyl)-N-propyl-thieno[2,3-b][1,5]benzothiazepine-7-sulfonamide Formula: C20H17ClN2O2S3 MolecularWeight: 449.00918

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC2=C(C=C1)SC3=C(C=CS3)C(=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCNS(=O)(=O)C1=CC2=C(C=C1)SC3=C(C=CS3)C(=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H17ClN2O2S3/c1-2-10-22-28(24,25)15-7-8-18-17(12-15)23-19(13-3-5-14(21)6-4-13)16-9-11-26-20(16)27-18/h3-9,11-12,22H,2,10H2,1H3