2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C21H26N4O2S2 MolecularWeight: 430.58674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3CCCSC4=CC=CC=C43

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3CCCSC4=CC=CC=C43

InChI

InChI=1S/C21H26N4O2S2/c1-4-25-18-11-10-16(29(26,27)23(2)3)14-17(18)22-21(25)15-24-12-7-13-28-20-9-6-5-8-19(20)24/h5-6,8-11,14H,4,7,12-13,15H2,1-3H3