2-(2-chlorophenyl)-4-(4-chlorophenyl)-8-fluoranyl-2,5-dihydro-1,5-benzothiazepine

Systemtic Name: 2-(2-chlorophenyl)-4-(4-chlorophenyl)-8-fluoranyl-2,5-dihydro-1,5-benzothiazepine Openeye Name: 2-(2-chlorophenyl)-4-(4-chlorophenyl)-8-fluoro-2,5-dihydro-1,5-benzothiazepine CAS Name: 2-(2-chlorophenyl)-4-(4-chlorophenyl)-8-fluoro-2,5-dihydro-1,5-benzothiazepine IUPAC Name: 2-(2-chlorophenyl)-4-(4-chlorophenyl)-8-fluoro-2,5-dihydro-1,5-benzothiazepine Traditional Name: 2-(2-chlorophenyl)-4-(4-chlorophenyl)-8-fluoro-2,5-dihydro-1,5-benzothiazepine Formula: C21H14Cl2FNS MolecularWeight: 402.311963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C=C(NC3=C(S2)C=C(C=C3)F)C4=CC=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2C=C(NC3=C(S2)C=C(C=C3)F)C4=CC=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H14Cl2FNS/c22-14-7-5-13(6-8-14)19-12-20(16-3-1-2-4-17(16)23)26-21-11-15(24)9-10-18(21)25-19/h1-12,20,25H