ethyl 2-[(2-bromophenyl)carbonylcarbamothioylamino]-4-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-bromophenyl)carbonylcarbamothioylamino]-4-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-bromobenzoyl)carbamothioylamino]-4-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[[[(2-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-bromobenzoyl)carbamothioylamino]-4-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[(2-bromobenzoyl)thiocarbamoylamino]-4-isopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H19BrN2O3S2 MolecularWeight: 455.38906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C(C)C)NC(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C(C)C)NC(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C18H19BrN2O3S2/c1-4-24-17(23)14-12(10(2)3)9-26-16(14)21-18(25)20-15(22)11-7-5-6-8-13(11)19/h5-10H,4H2,1-3H3,(H2,20,21,22,25)