N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-1-(5-cyanopyridin-2-yl)-N-propyl-piperidine-4-carboxamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-1-(5-cyanopyridin-2-yl)-N-propyl-piperidine-4-carboxamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-1-(5-cyano-2-pyridyl)-N-propyl-piperidine-4-carboxamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-1-(5-cyano-2-pyridinyl)-N-propyl-4-piperidinecarboxamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-1-(5-cyanopyridin-2-yl)-N-propylpiperidine-4-carboxamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-1-(5-cyano-2-pyridyl)-N-propyl-isonipecotamide Formula: C26H29N7O3 MolecularWeight: 487.55356

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

CCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C26H29N7O3/c1-2-12-32(22-23(28)33(26(36)30-24(22)34)17-18-6-4-3-5-7-18)25(35)20-10-13-31(14-11-20)21-9-8-19(15-27)16-29-21/h3-9,16,20H,2,10-14,17,28H2,1H3,(H,30,34,36)