8-chloranyl-N-[(2-chlorophenyl)methyl]-6-methylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 8-chloranyl-N-[(2-chlorophenyl)methyl]-6-methylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 8-chloro-N-[(2-chlorophenyl)methyl]-6-methylene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 8-chloro-N-[(2-chlorophenyl)methyl]-6-methylene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide IUPAC Name: 8-chloro-N-[(2-chlorophenyl)methyl]-6-methylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 8-chloro-N-(2-chlorobenzyl)-6-methylene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C22H16Cl2N2OS MolecularWeight: 427.34624

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=C(C=CC(=C2)Cl)SC3=C(N1)C=C(C=C3)C(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

C=C1C2=C(C=CC(=C2)Cl)SC3=C(N1)C=C(C=C3)C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C22H16Cl2N2OS/c1-13-17-11-16(23)7-9-20(17)28-21-8-6-14(10-19(21)26-13)22(27)25-12-15-4-2-3-5-18(15)24/h2-11,26H,1,12H2,(H,25,27)