N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]-5-phenyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]-5-phenyl-1,2-oxazole-3-carboxamide Openeye Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-5-phenyl-isoxazole-3-carboxamide CAS Name: N-[2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-3-pyrazolyl]-5-phenyl-3-isoxazolecarboxamide IUPAC Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-5-phenyl-1,2-oxazole-3-carboxamide Traditional Name: N-[2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-5-phenyl-isoxazole-3-carboxamide Formula: C29H22N6O3S MolecularWeight: 534.58838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=NOC(=C4)C5=CC=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=NOC(=C4)C5=CC=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C29H22N6O3S/c1-18-21(15-19-9-4-2-5-10-19)27(36)32-29(30-18)35-26(17-22(33-35)25-13-8-14-39-25)31-28(37)23-16-24(38-34-23)20-11-6-3-7-12-20/h2-14,16-17H,15H2,1H3,(H,31,37)(H,30,32,36)