3-chloranyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-one

Systemtic Name: 3-chloranyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-one Openeye Name: 3-chloro-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-one CAS Name: 3-chloro-6-phenyl-7-pyrrolo[2,1-d][1,5]benzothiazepinone IUPAC Name: 3-chloro-6-phenylpyrrolo[2,1-d][1,5]benzothiazepin-7-one Traditional Name: 3-chloro-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-one Formula: C18H12ClNOS MolecularWeight: 325.81198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=O)C3=CC=CN3C4=C(S2)C=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2C(=O)C3=CC=CN3C4=C(S2)C=C(C=C4)Cl

InChI

InChI=1S/C18H12ClNOS/c19-13-8-9-14-16(11-13)22-18(12-5-2-1-3-6-12)17(21)15-7-4-10-20(14)15/h1-11,18H