6-ethyl-2-methyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-one

Systemtic Name: 6-ethyl-2-methyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-one Openeye Name: 6-ethyl-2-methyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-one CAS Name: 6-ethyl-2-methyl-6-phenyl-7-pyrrolo[2,1-d][1,5]benzothiazepinone IUPAC Name: 6-ethyl-2-methyl-6-phenylpyrrolo[2,1-d][1,5]benzothiazepin-7-one Traditional Name: 6-ethyl-2-methyl-6-phenyl-pyrrolo[2,1-d][1,5]benzothiazepin-7-one Formula: C21H19NOS MolecularWeight: 333.44666

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C2=CC=CN2C3=C(S1)C=CC(=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCC1(C(=O)C2=CC=CN2C3=C(S1)C=CC(=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C21H19NOS/c1-3-21(16-8-5-4-6-9-16)20(23)17-10-7-13-22(17)18-14-15(2)11-12-19(18)24-21/h4-14H,3H2,1-2H3