N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(phenylmethyl)-2-(1-phenylpyrazol-4-yl)ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(phenylmethyl)-2-(1-phenylpyrazol-4-yl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-benzyl-2-(1-phenylpyrazol-4-yl)acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(phenylmethyl)-2-(1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-benzyl-2-(1-phenylpyrazol-4-yl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-benzyl-2-(1-phenylpyrazol-4-yl)acetamide Formula: C26H28N6O3 MolecularWeight: 472.53892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)CC3=CN(N=C3)C4=CC=CC=C4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)CC3=CN(N=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C26H28N6O3/c1-2-3-14-30-24(27)23(25(34)29-26(30)35)31(17-19-10-6-4-7-11-19)22(33)15-20-16-28-32(18-20)21-12-8-5-9-13-21/h4-13,16,18H,2-3,14-15,17,27H2,1H3,(H,29,34,35)