ethyl 2-methyl-5-[(2-phenylsulfanylphenyl)carbamoyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-[(2-phenylsulfanylphenyl)carbamoyl]pyrazole-3-carboxylate Openeye Name: ethyl 2-methyl-5-[(2-phenylsulfanylphenyl)carbamoyl]pyrazole-3-carboxylate CAS Name: 2-methyl-5-[oxo-[2-(phenylthio)anilino]methyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-[(2-phenylsulfanylphenyl)carbamoyl]pyrazole-3-carboxylate Traditional Name: 2-methyl-5-[[2-(phenylthio)phenyl]carbamoyl]pyrazole-3-carboxylic acid ethyl ester Formula: C20H19N3O3S MolecularWeight: 381.44816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3S/c1-3-26-20(25)17-13-16(22-23(17)2)19(24)21-15-11-7-8-12-18(15)27-14-9-5-4-6-10-14/h4-13H,3H2,1-2H3,(H,21,24)