methyl 5-[3-[(3-methylphenyl)carbonylamino]propanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-[3-[(3-methylphenyl)carbonylamino]propanoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-[3-[(3-methylbenzoyl)amino]propanoylamino]thiophene-2-carboxylate CAS Name: 5-[[3-[[(3-methylphenyl)-oxomethyl]amino]-1-oxopropyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[3-[(3-methylbenzoyl)amino]propanoylamino]thiophene-2-carboxylate Traditional Name: 5-[3-(m-toluoylamino)propanoylamino]thiophene-2-carboxylic acid methyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCC(=O)NC2=CC=C(S2)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCC(=O)NC2=CC=C(S2)C(=O)OC

InChI

InChI=1S/C17H18N2O4S/c1-11-4-3-5-12(10-11)16(21)18-9-8-14(20)19-15-7-6-13(24-15)17(22)23-2/h3-7,10H,8-9H2,1-2H3,(H,18,21)(H,19,20)