ethyl 2,5-dimethyl-4-[(Z)-(2-oxidanylidene-1H-indol-3-ylidene)methyl]-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[(Z)-(2-oxidanylidene-1H-indol-3-ylidene)methyl]-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[(Z)-(2-oxoindolin-3-ylidene)methyl]-1-(2-thienylmethyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1-(thiophen-2-ylmethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate Traditional Name: 4-[(Z)-(2-ketoindolin-3-ylidene)methyl]-2,5-dimethyl-1-(2-thenyl)pyrrole-3-carboxylic acid ethyl ester Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C=C2C3=CC=CC=C3NC2=O)C)CC4=CC=CS4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1/C=C\2/C3=CC=CC=C3NC2=O)C)CC4=CC=CS4)C

InChI

InChI=1S/C23H22N2O3S/c1-4-28-23(27)21-15(3)25(13-16-8-7-11-29-16)14(2)18(21)12-19-17-9-5-6-10-20(17)24-22(19)26/h5-12H,4,13H2,1-3H3,(H,24,26)/b19-12-