3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-[[4-(2-methylpyrazol-3-yl)phenyl]methyl]-1-(phenylmethyl)urea

Systemtic Name: 3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-[[4-(2-methylpyrazol-3-yl)phenyl]methyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-1-[[4-(2-methylpyrazol-3-yl)phenyl]methyl]urea CAS Name: 3-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-1-[[4-(2-methyl-3-pyrazolyl)phenyl]methyl]-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-[[4-(2-methylpyrazol-3-yl)phenyl]methyl]urea Traditional Name: 1-benzyl-3-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-1-[4-(2-methylpyrazol-3-yl)benzyl]urea Formula: C27H29N5OS2 MolecularWeight: 503.68206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)C4=CC=NN4C)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)C4=CC=NN4C)SC

InChI

InChI=1S/C27H29N5OS2/c1-19-16-24(34-3)25(26(29-19)35-4)30-27(33)32(17-20-8-6-5-7-9-20)18-21-10-12-22(13-11-21)23-14-15-28-31(23)2/h5-16H,17-18H2,1-4H3,(H,30,33)