1-(3-methoxyphenyl)-4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]cyclohexane-1-carbonitrile

Systemtic Name: 1-(3-methoxyphenyl)-4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]cyclohexane-1-carbonitrile Openeye Name: 1-(3-methoxyphenyl)-4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]cyclohexanecarbonitrile CAS Name: 1-(3-methoxyphenyl)-4-[4-(4-methoxy-2-pyrimidinyl)-1-piperazinyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-(3-methoxyphenyl)-4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]cyclohexane-1-carbonitrile Traditional Name: 1-(3-methoxyphenyl)-4-[4-(4-methoxypyrimidin-2-yl)piperazino]cyclohexanecarbonitrile Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2CCN(CC2)C3CCC(CC3)(C#N)C4=CC(=CC=C4)OC

Isomeric SMILES

COC1=NC(=NC=C1)N2CCN(CC2)C3CCC(CC3)(C#N)C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H29N5O2/c1-29-20-5-3-4-18(16-20)23(17-24)9-6-19(7-10-23)27-12-14-28(15-13-27)22-25-11-8-21(26-22)30-2/h3-5,8,11,16,19H,6-7,9-10,12-15H2,1-2H3