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

Systemtic Name: 4-[(E)-2-cyano-3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-2-cyano-3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-oxo-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-2-cyano-3-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]-3-oxoprop-1-enyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-2-cyano-3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-oxoprop-1-enyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-2-cyano-3-keto-3-(4-p-anisylpiperazino)prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C23H25N5O2 MolecularWeight: 403.4769

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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)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C(\C#N)/C(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H25N5O2/c1-17-19(13-21(15-25)26(17)2)12-20(14-24)23(29)28-10-8-27(9-11-28)16-18-4-6-22(30-3)7-5-18/h4-7,12-13H,8-11,16H2,1-3H3/b20-12+