4-[(E)-2-cyano-3-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[(E)-2-cyano-3-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-2-cyano-3-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-oxo-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-2-cyano-3-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-oxoprop-1-enyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-2-cyano-3-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-oxoprop-1-enyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-2-cyano-3-keto-3-(4-p-anisoylpiperazino)prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=C(C#N)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C(\C#N)/C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H23N5O3/c1-16-18(13-20(15-25)26(16)2)12-19(14-24)23(30)28-10-8-27(9-11-28)22(29)17-4-6-21(31-3)7-5-17/h4-7,12-13H,8-11H2,1-3H3/b19-12+