propan-2-yl 4-cyano-3-methyl-5-[(2-phenylcyclopropyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-3-methyl-5-[(2-phenylcyclopropyl)carbonylamino]thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-3-methyl-5-[(2-phenylcyclopropanecarbonyl)amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo-(2-phenylcyclopropyl)methyl]amino]-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-methyl-5-[(2-phenylcyclopropanecarbonyl)amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[(2-phenylcyclopropanecarbonyl)amino]thiophene-2-carboxylic acid isopropyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2CC2C3=CC=CC=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2CC2C3=CC=CC=C3)C(=O)OC(C)C

InChI

InChI=1S/C20H20N2O3S/c1-11(2)25-20(24)17-12(3)16(10-21)19(26-17)22-18(23)15-9-14(15)13-7-5-4-6-8-13/h4-8,11,14-15H,9H2,1-3H3,(H,22,23)