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

Systemtic Name: 2-[(4-bromophenyl)carbonylamino]-4-(2-methylpropyl)thiophene-3-carboxylate Openeye Name: 2-[(4-bromobenzoyl)amino]-4-isobutyl-thiophene-3-carboxylate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]amino]-4-(2-methylpropyl)-3-thiophenecarboxylate IUPAC Name: 2-[(4-bromobenzoyl)amino]-4-(2-methylpropyl)thiophene-3-carboxylate Traditional Name: 2-[(4-bromobenzoyl)amino]-4-isobutyl-3-thenoate Formula: C16H15BrNO3S- MolecularWeight: 381.2642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CSC(=C1C(=O)[O-])NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)CC1=CSC(=C1C(=O)[O-])NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H16BrNO3S/c1-9(2)7-11-8-22-15(13(11)16(20)21)18-14(19)10-3-5-12(17)6-4-10/h3-6,8-9H,7H2,1-2H3,(H,18,19)(H,20,21)/p-1