N-[[2-cyano-4-(2-methylpropylamino)pyrimidin-5-yl]methyl]-4-(1-propylpiperidin-4-yl)benzamide

Systemtic Name: N-[[2-cyano-4-(2-methylpropylamino)pyrimidin-5-yl]methyl]-4-(1-propylpiperidin-4-yl)benzamide Openeye Name: N-[[2-cyano-4-(isobutylamino)pyrimidin-5-yl]methyl]-4-(1-propyl-4-piperidyl)benzamide CAS Name: N-[[2-cyano-4-(2-methylpropylamino)-5-pyrimidinyl]methyl]-4-(1-propyl-4-piperidinyl)benzamide IUPAC Name: N-[[2-cyano-4-(2-methylpropylamino)pyrimidin-5-yl]methyl]-4-(1-propylpiperidin-4-yl)benzamide Traditional Name: N-[[2-cyano-4-(isobutylamino)pyrimidin-5-yl]methyl]-4-(1-propyl-4-piperidyl)benzamide Formula: C25H34N6O MolecularWeight: 434.57706

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)C2=CC=C(C=C2)C(=O)NCC3=CN=C(N=C3NCC(C)C)C#N

Isomeric SMILES

CCCN1CCC(CC1)C2=CC=C(C=C2)C(=O)NCC3=CN=C(N=C3NCC(C)C)C#N

InChI

InChI=1S/C25H34N6O/c1-4-11-31-12-9-20(10-13-31)19-5-7-21(8-6-19)25(32)29-17-22-16-27-23(14-26)30-24(22)28-15-18(2)3/h5-8,16,18,20H,4,9-13,15,17H2,1-3H3,(H,29,32)(H,27,28,30)