ethyl 1-cyano-2-[(4-methylphenyl)sulfonylamino]pyrrolo[2,1-a]isoquinoline-3-carboxylate

Systemtic Name: ethyl 1-cyano-2-[(4-methylphenyl)sulfonylamino]pyrrolo[2,1-a]isoquinoline-3-carboxylate Openeye Name: ethyl 1-cyano-2-(p-tolylsulfonylamino)pyrrolo[2,1-a]isoquinoline-3-carboxylate CAS Name: 1-cyano-2-[(4-methylphenyl)sulfonylamino]-3-pyrrolo[2,1-a]isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyano-2-[(4-methylphenyl)sulfonylamino]pyrrolo[2,1-a]isoquinoline-3-carboxylate Traditional Name: 1-cyano-2-(tosylamino)pyrrol[2,1-a]isoquinoline-3-carboxylic acid ethyl ester Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2N1C=CC3=CC=CC=C32)C#N)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C2N1C=CC3=CC=CC=C32)C#N)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H19N3O4S/c1-3-30-23(27)22-20(25-31(28,29)17-10-8-15(2)9-11-17)19(14-24)21-18-7-5-4-6-16(18)12-13-26(21)22/h4-13,25H,3H2,1-2H3