methyl 3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-pyrazol-1-yl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-pyrazol-1-yl]thiophene-2-carboxylate Openeye Name: methyl 3-[5-(tert-butoxycarbonylamino)-3-phenyl-pyrazol-1-yl]thiophene-2-carboxylate CAS Name: 3-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenyl-1-pyrazolyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpyrazol-1-yl]thiophene-2-carboxylate Traditional Name: 3-[5-(tert-butoxycarbonylamino)-3-phenyl-pyrazol-1-yl]thiophene-2-carboxylic acid methyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=NN1C2=C(SC=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=NN1C2=C(SC=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O4S/c1-20(2,3)27-19(25)21-16-12-14(13-8-6-5-7-9-13)22-23(16)15-10-11-28-17(15)18(24)26-4/h5-12H,1-4H3,(H,21,25)