N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-[(2-methoxyphenyl)methyl]-4-pyrazol-1-yl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-[(2-methoxyphenyl)methyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-[(2-methoxyphenyl)methyl]-4-pyrazol-1-yl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-[(2-methoxyphenyl)methyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-[(2-methoxyphenyl)methyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-o-anisyl-4-pyrazol-1-yl-benzamide Formula: C26H28N6O4 MolecularWeight: 488.53832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2OC)C(=O)C3=CC=C(C=C3)N4C=CC=N4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2OC)C(=O)C3=CC=C(C=C3)N4C=CC=N4)N

InChI

InChI=1S/C26H28N6O4/c1-3-4-15-30-23(27)22(24(33)29-26(30)35)31(17-19-8-5-6-9-21(19)36-2)25(34)18-10-12-20(13-11-18)32-16-7-14-28-32/h5-14,16H,3-4,15,17,27H2,1-2H3,(H,29,33,35)