2-[(3-methylphenyl)carbonylamino]-4-(2-methylpropyl)thiophene-3-carboxylate

Systemtic Name: 2-[(3-methylphenyl)carbonylamino]-4-(2-methylpropyl)thiophene-3-carboxylate Openeye Name: 4-isobutyl-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]-4-(2-methylpropyl)-3-thiophenecarboxylate IUPAC Name: 2-[(3-methylbenzoyl)amino]-4-(2-methylpropyl)thiophene-3-carboxylate Traditional Name: 4-isobutyl-2-(m-toluoylamino)-3-thenoate Formula: C17H18NO3S- MolecularWeight: 316.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)CC(C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)CC(C)C)C(=O)[O-]

InChI

InChI=1S/C17H19NO3S/c1-10(2)7-13-9-22-16(14(13)17(20)21)18-15(19)12-6-4-5-11(3)8-12/h4-6,8-10H,7H2,1-3H3,(H,18,19)(H,20,21)/p-1