4-tert-butyl-N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]benzamide Openeye Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-3-pyrazolyl]benzamide IUPAC Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-4-tert-butylbenzamide Traditional Name: N-[2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-4-tert-butyl-benzamide Formula: C30H29N5O2S MolecularWeight: 523.64856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=CC=C(C=C4)C(C)(C)C)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=CC=C(C=C4)C(C)(C)C)CC5=CC=CC=C5

InChI

InChI=1S/C30H29N5O2S/c1-19-23(17-20-9-6-5-7-10-20)28(37)33-29(31-19)35-26(18-24(34-35)25-11-8-16-38-25)32-27(36)21-12-14-22(15-13-21)30(2,3)4/h5-16,18H,17H2,1-4H3,(H,32,36)(H,31,33,37)