N-butyl-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide

Systemtic Name: N-butyl-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide Openeye Name: N-butyl-5-(5-methyl-2-thienyl)-1H-pyrazole-3-carboxamide CAS Name: N-butyl-5-(5-methyl-2-thiophenyl)-1H-pyrazole-3-carboxamide IUPAC Name: N-butyl-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide Traditional Name: N-butyl-5-(5-methyl-2-thienyl)-1H-pyrazole-3-carboxamide Formula: C13H17N3OS MolecularWeight: 263.35858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=NNC(=C1)C2=CC=C(S2)C

Isomeric SMILES

CCCCNC(=O)C1=NNC(=C1)C2=CC=C(S2)C

InChI

InChI=1S/C13H17N3OS/c1-3-4-7-14-13(17)11-8-10(15-16-11)12-6-5-9(2)18-12/h5-6,8H,3-4,7H2,1-2H3,(H,14,17)(H,15,16)