9-chloranyl-8-morpholin-4-ylsulfonyl-5H-benzo[b][1,4]benzothiazepin-6-one

Systemtic Name: 9-chloranyl-8-morpholin-4-ylsulfonyl-5H-benzo[b][1,4]benzothiazepin-6-one Openeye Name: 9-chloro-8-morpholinosulfonyl-5H-benzo[b][1,4]benzothiazepin-6-one CAS Name: 9-chloro-8-(4-morpholinylsulfonyl)-5H-benzo[b][1,4]benzothiazepin-6-one IUPAC Name: 9-chloro-8-morpholin-4-ylsulfonyl-5H-benzo[b][1,4]benzothiazepin-6-one Traditional Name: 9-chloro-8-morpholinosulfonyl-5H-benzo[b][1,4]benzothiazepin-6-one Formula: C17H15ClN2O4S2 MolecularWeight: 410.895

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=C3C(=C2)C(=O)NC4=CC=CC=C4S3)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=C3C(=C2)C(=O)NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C17H15ClN2O4S2/c18-12-10-15-11(17(21)19-13-3-1-2-4-14(13)25-15)9-16(12)26(22,23)20-5-7-24-8-6-20/h1-4,9-10H,5-8H2,(H,19,21)