2,4-bis(3,4-dichlorophenyl)-2,3-dihydro-1,5-benzothiazepine

Systemtic Name: 2,4-bis(3,4-dichlorophenyl)-2,3-dihydro-1,5-benzothiazepine Openeye Name: 2,4-bis(3,4-dichlorophenyl)-2,3-dihydro-1,5-benzothiazepine CAS Name: 2,4-bis(3,4-dichlorophenyl)-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 2,4-bis(3,4-dichlorophenyl)-2,3-dihydro-1,5-benzothiazepine Traditional Name: 2,4-bis(3,4-dichlorophenyl)-2,3-dihydro-1,5-benzothiazepine Formula: C21H13Cl4NS MolecularWeight: 453.21162

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CC(=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1C(SC2=CC=CC=C2N=C1C3=CC(=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H13Cl4NS/c22-14-7-5-12(9-16(14)24)19-11-21(13-6-8-15(23)17(25)10-13)27-20-4-2-1-3-18(20)26-19/h1-10,21H,11H2