8-morpholin-4-ylsulfonyl-N-phenyl-benzo[b][1,4]benzothiazepin-6-amine

Systemtic Name: 8-morpholin-4-ylsulfonyl-N-phenyl-benzo[b][1,4]benzothiazepin-6-amine Openeye Name: 8-morpholinosulfonyl-N-phenyl-benzo[b][1,4]benzothiazepin-6-amine CAS Name: 8-(4-morpholinylsulfonyl)-N-phenyl-6-benzo[b][1,4]benzothiazepinamine IUPAC Name: 8-morpholin-4-ylsulfonyl-N-phenylbenzo[b][1,4]benzothiazepin-6-amine Traditional Name: (8-morpholinosulfonylbenzo[b][1,4]benzothiazepin-6-yl)-phenyl-amine Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4N=C3NC5=CC=CC=C5

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4N=C3NC5=CC=CC=C5

InChI

InChI=1S/C23H21N3O3S2/c27-31(28,26-12-14-29-15-13-26)18-10-11-21-19(16-18)23(24-17-6-2-1-3-7-17)25-20-8-4-5-9-22(20)30-21/h1-11,16H,12-15H2,(H,24,25)