N-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-2-[[5-[(3,4-dimethylphenoxy)methyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-2-[[5-[(3,4-dimethylphenoxy)methyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-benzyl-5-[(3,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)acetamide CAS Name: N-(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-[[5-[(3,4-dimethylphenoxy)methyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-benzyl-5-[(3,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)acetamide Traditional Name: 2-[[4-benzyl-5-[(3,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)acetamide Formula: C26H28N6O4S MolecularWeight: 520.60332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NC4=CC(=O)N(C(=O)N4C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NC4=CC(=O)N(C(=O)N4C)C)C

InChI

InChI=1S/C26H28N6O4S/c1-17-10-11-20(12-18(17)2)36-15-22-28-29-25(32(22)14-19-8-6-5-7-9-19)37-16-23(33)27-21-13-24(34)31(4)26(35)30(21)3/h5-13H,14-16H2,1-4H3,(H,27,33)