(2-methyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-yl) ethanoate

Systemtic Name: (2-methyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-yl) ethanoate Openeye Name: (2-methyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-yl) acetate CAS Name: acetic acid (2-methyl-6-phenyl-7-pyrrolo[2,1-d][1,5]benzothiazepinyl) ester IUPAC Name: (2-methyl-6-phenylpyrrolo[2,1-d][1,5]benzothiazepin-7-yl) acetate Traditional Name: acetic acid (2-methyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-yl) ester Formula: C21H17NO2S MolecularWeight: 347.43018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=C(C3=CC=CN32)OC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=C(C3=CC=CN32)OC(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C21H17NO2S/c1-14-10-11-19-18(13-14)22-12-6-9-17(22)20(24-15(2)23)21(25-19)16-7-4-3-5-8-16/h3-13H,1-2H3