N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-pyrrol-1-yl-thiophene-2-carboxamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-pyrrol-1-yl-thiophene-2-carboxamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-pyrrol-1-yl-thiophene-2-carboxamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-3-(1-pyrrolyl)-2-thiophenecarboxamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-3-pyrrol-1-ylthiophene-2-carboxamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-pyrrol-1-yl-thiophene-2-carboxamide Formula: C22H22N4OS MolecularWeight: 390.50128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C22H22N4OS/c1-16-19(17(2)26(24-16)15-18-8-4-3-5-9-18)14-23-22(27)21-20(10-13-28-21)25-11-6-7-12-25/h3-13H,14-15H2,1-2H3,(H,23,27)