[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-(3-methylbut-2-enoylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-(3-methylbut-2-enoylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-(3-methylbut-2-enoylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[(3-methyl-1-oxobut-2-enyl)amino]-4-phenyl-3-thiophenecarboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-(3-methylbut-2-enoylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(3-methylbut-2-enoylamino)-4-phenyl-thiophene-3-carboxylic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C=C(C)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C=C(C)C

InChI

InChI=1S/C22H25N3O5S/c1-4-10-23-22(29)25-18(27)12-30-21(28)19-16(15-8-6-5-7-9-15)13-31-20(19)24-17(26)11-14(2)3/h5-9,11,13H,4,10,12H2,1-3H3,(H,24,26)(H2,23,25,27,29)