N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-(phenylthio)nicotinamide Formula: C24H22N4OS MolecularWeight: 414.52268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H22N4OS/c1-27(16-20-15-26-28(18-20)17-19-9-4-2-5-10-19)24(29)22-13-8-14-25-23(22)30-21-11-6-3-7-12-21/h2-15,18H,16-17H2,1H3