4-chloranyl-2-(cyclopropylmethylamino)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-2-(cyclopropylmethylamino)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidine-5-carbonitrile Openeye Name: 4-chloro-2-(cyclopropylmethylamino)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidine-5-carbonitrile CAS Name: 4-chloro-2-(cyclopropylmethylamino)-6-[4-(4-fluorophenyl)-1-piperazinyl]-5-pyrimidinecarbonitrile IUPAC Name: 4-chloro-2-(cyclopropylmethylamino)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidine-5-carbonitrile Traditional Name: 4-chloro-2-(cyclopropylmethylamino)-6-[4-(4-fluorophenyl)piperazino]pyrimidine-5-carbonitrile Formula: C19H20ClFN6 MolecularWeight: 386.853703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC2=NC(=C(C(=N2)Cl)C#N)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC1CNC2=NC(=C(C(=N2)Cl)C#N)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H20ClFN6/c20-17-16(11-22)18(25-19(24-17)23-12-13-1-2-13)27-9-7-26(8-10-27)15-5-3-14(21)4-6-15/h3-6,13H,1-2,7-10,12H2,(H,23,24,25)