ethyl 5-[3-azanyl-2-cyano-3-(4-methylpiperazin-1-yl)prop-2-enylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[3-azanyl-2-cyano-3-(4-methylpiperazin-1-yl)prop-2-enylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[3-amino-2-cyano-3-(4-methylpiperazin-1-yl)prop-2-enylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate CAS Name: 5-[3-amino-2-cyano-3-(4-methyl-1-piperazinyl)prop-2-enylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-amino-2-cyano-3-(4-methylpiperazin-1-yl)prop-2-enylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: 5-[3-amino-2-cyano-3-(4-methylpiperazino)prop-2-enylidene]-4-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C17H23N5O3 MolecularWeight: 345.39622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=CC(=C(N)N2CCN(CC2)C)C#N)C1=O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=CC(=C(N)N2CCN(CC2)C)C#N)C1=O)C

InChI

InChI=1S/C17H23N5O3/c1-4-25-17(24)14-11(2)20-13(15(14)23)9-12(10-18)16(19)22-7-5-21(3)6-8-22/h9,20H,4-8,19H2,1-3H3