2,4-bis(cyclopropylmethylamino)-6-(4-phenylpiperazin-1-yl)pyrimidine-5-carbonitrile

Systemtic Name: 2,4-bis(cyclopropylmethylamino)-6-(4-phenylpiperazin-1-yl)pyrimidine-5-carbonitrile Openeye Name: 2,4-bis(cyclopropylmethylamino)-6-(4-phenylpiperazin-1-yl)pyrimidine-5-carbonitrile CAS Name: 2,4-bis(cyclopropylmethylamino)-6-(4-phenyl-1-piperazinyl)-5-pyrimidinecarbonitrile IUPAC Name: 2,4-bis(cyclopropylmethylamino)-6-(4-phenylpiperazin-1-yl)pyrimidine-5-carbonitrile Traditional Name: 2,4-bis(cyclopropylmethylamino)-6-(4-phenylpiperazino)pyrimidine-5-carbonitrile Formula: C23H29N7 MolecularWeight: 403.52326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC2=NC(=NC(=C2C#N)N3CCN(CC3)C4=CC=CC=C4)NCC5CC5

Isomeric SMILES

C1CC1CNC2=NC(=NC(=C2C#N)N3CCN(CC3)C4=CC=CC=C4)NCC5CC5

InChI

InChI=1S/C23H29N7/c24-14-20-21(25-15-17-6-7-17)27-23(26-16-18-8-9-18)28-22(20)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,17-18H,6-13,15-16H2,(H2,25,26,27,28)