(1-azanyl-1-oxidanylidene-propan-2-yl) 1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxylate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxylate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 1-phenyl-3-(2-thienyl)pyrazole-4-carboxylate CAS Name: 1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxylic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 1-phenyl-3-thiophen-2-ylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(2-thienyl)pyrazole-4-carboxylic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C17H15N3O3S MolecularWeight: 341.3843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3O3S/c1-11(16(18)21)23-17(22)13-10-20(12-6-3-2-4-7-12)19-15(13)14-8-5-9-24-14/h2-11H,1H3,(H2,18,21)