3-[4-[3-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[4-[3-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-[3-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-oxo-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile CAS Name: 3-[4-[3-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]-3,5-dimethyl-1-pyrazolyl]propanenitrile IUPAC Name: 3-[4-[3-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-oxopropyl]-3,5-dimethylpyrazol-1-yl]propanenitrile Traditional Name: 3-[4-[3-keto-3-(4-p-anisoylpiperazino)propyl]-3,5-dimethyl-pyrazol-1-yl]propionitrile Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H29N5O3/c1-17-21(18(2)28(25-17)12-4-11-24)9-10-22(29)26-13-15-27(16-14-26)23(30)19-5-7-20(31-3)8-6-19/h5-8H,4,9-10,12-16H2,1-3H3