2-[[4-[[(5-chloranylpyrimidin-2-yl)amino]methyl]cyclohexyl]amino]-1-ethanoyl-pyrrolidine-2-carbonitrile

Systemtic Name: 2-[[4-[[(5-chloranylpyrimidin-2-yl)amino]methyl]cyclohexyl]amino]-1-ethanoyl-pyrrolidine-2-carbonitrile Openeye Name: 1-acetyl-2-[[4-[[(5-chloropyrimidin-2-yl)amino]methyl]cyclohexyl]amino]pyrrolidine-2-carbonitrile CAS Name: 1-acetyl-2-[[4-[[(5-chloro-2-pyrimidinyl)amino]methyl]cyclohexyl]amino]-2-pyrrolidinecarbonitrile IUPAC Name: 1-acetyl-2-[[4-[[(5-chloropyrimidin-2-yl)amino]methyl]cyclohexyl]amino]pyrrolidine-2-carbonitrile Traditional Name: 1-acetyl-2-[[4-[[(5-chloropyrimidin-2-yl)amino]methyl]cyclohexyl]amino]pyrrolidine-2-carbonitrile Formula: C18H25ClN6O MolecularWeight: 376.8837

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1(C#N)NC2CCC(CC2)CNC3=NC=C(C=N3)Cl

Isomeric SMILES

CC(=O)N1CCCC1(C#N)NC2CCC(CC2)CNC3=NC=C(C=N3)Cl

InChI

InChI=1S/C18H25ClN6O/c1-13(26)25-8-2-7-18(25,12-20)24-16-5-3-14(4-6-16)9-21-17-22-10-15(19)11-23-17/h10-11,14,16,24H,2-9H2,1H3,(H,21,22,23)