3-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxo-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile CAS Name: 3-[4-[3-[4-(2-methoxyphenyl)-1-piperazinyl]-3-oxopropyl]-3,5-dimethyl-1-pyrazolyl]propanenitrile IUPAC Name: 3-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]-3,5-dimethylpyrazol-1-yl]propanenitrile Traditional Name: 3-[4-[3-keto-3-[4-(2-methoxyphenyl)piperazino]propyl]-3,5-dimethyl-pyrazol-1-yl]propionitrile Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)N2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)N2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C22H29N5O2/c1-17-19(18(2)27(24-17)12-6-11-23)9-10-22(28)26-15-13-25(14-16-26)20-7-4-5-8-21(20)29-3/h4-5,7-8H,6,9-10,12-16H2,1-3H3