ethyl 3-azanyl-2-[(4-bromophenyl)carbonylcarbamothioyl]but-2-enoate

Systemtic Name: ethyl 3-azanyl-2-[(4-bromophenyl)carbonylcarbamothioyl]but-2-enoate Openeye Name: ethyl 3-amino-2-[(4-bromobenzoyl)carbamothioyl]but-2-enoate CAS Name: 3-amino-2-[[[(4-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl 3-amino-2-[(4-bromobenzoyl)carbamothioyl]but-2-enoate Traditional Name: 3-amino-2-[(4-bromobenzoyl)thiocarbamoyl]but-2-enoic acid ethyl ester Formula: C14H15BrN2O3S MolecularWeight: 371.2495

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)N)C(=S)NC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCOC(=O)C(=C(C)N)C(=S)NC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C14H15BrN2O3S/c1-3-20-14(19)11(8(2)16)13(21)17-12(18)9-4-6-10(15)7-5-9/h4-7H,3,16H2,1-2H3,(H,17,18,21)