4-chloranyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepine

Systemtic Name: 4-chloranyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepine Openeye Name: 4-chloro-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepine CAS Name: 4-chloro-6-phenylpyrrolo[2,1-d][1,5]benzothiazepine IUPAC Name: 4-chloro-6-phenylpyrrolo[2,1-d][1,5]benzothiazepine Traditional Name: 4-chloro-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepine Formula: C18H12ClNS MolecularWeight: 309.81258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=CC=CN3C4=C(S2)C(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=CC=CN3C4=C(S2)C(=CC=C4)Cl

InChI

InChI=1S/C18H12ClNS/c19-15-9-4-10-16-18(15)21-17(13-6-2-1-3-7-13)12-14-8-5-11-20(14)16/h1-12H