methyl 3-[[4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)phenyl]carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)phenyl]carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)benzoyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[[4-(4-chloro-3,5-dimethyl-1-pyrazolyl)phenyl]-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[4-(4-chloro-3,5-dimethylpyrazol-1-yl)benzoyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)benzoyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C20H20ClN3O3S MolecularWeight: 417.9091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC(CC(=O)OC)C3=CC=CS3)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC(CC(=O)OC)C3=CC=CS3)C)Cl

InChI

InChI=1S/C20H20ClN3O3S/c1-12-19(21)13(2)24(23-12)15-8-6-14(7-9-15)20(26)22-16(11-18(25)27-3)17-5-4-10-28-17/h4-10,16H,11H2,1-3H3,(H,22,26)