4-oxidanylidene-N-[(4-pyrazol-1-ylphenyl)methyl]-4-thiophen-2-yl-butanamide

Systemtic Name: 4-oxidanylidene-N-[(4-pyrazol-1-ylphenyl)methyl]-4-thiophen-2-yl-butanamide Openeye Name: 4-oxo-N-[(4-pyrazol-1-ylphenyl)methyl]-4-(2-thienyl)butanamide CAS Name: 4-oxo-N-[[4-(1-pyrazolyl)phenyl]methyl]-4-thiophen-2-ylbutanamide IUPAC Name: 4-oxo-N-[(4-pyrazol-1-ylphenyl)methyl]-4-thiophen-2-ylbutanamide Traditional Name: 4-keto-N-(4-pyrazol-1-ylbenzyl)-4-(2-thienyl)butyramide Formula: C18H17N3O2S MolecularWeight: 339.41148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)CNC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)CNC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C18H17N3O2S/c22-16(17-3-1-12-24-17)8-9-18(23)19-13-14-4-6-15(7-5-14)21-11-2-10-20-21/h1-7,10-12H,8-9,13H2,(H,19,23)