ethyl 2-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-isobutylisoxazole-3-carbonyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[5-(2-methylpropyl)-3-isoxazolyl]-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(2-methylpropyl)-1,2-oxazole-3-carbonyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(5-isobutylisoxazole-3-carbonyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=NOC(=C3)CC(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=NOC(=C3)CC(C)C

InChI

InChI=1S/C21H22N2O4S/c1-4-26-21(25)18-16(14-8-6-5-7-9-14)12-28-20(18)22-19(24)17-11-15(27-23-17)10-13(2)3/h5-9,11-13H,4,10H2,1-3H3,(H,22,24)