3-(5-bromanyl-2-methoxy-phenyl)-N-[[(4-chlorophenyl)carbonylamino]carbamothioyl]prop-2-enamide

Systemtic Name: 3-(5-bromanyl-2-methoxy-phenyl)-N-[[(4-chlorophenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: 3-(5-bromo-2-methoxy-phenyl)-N-[[(4-chlorobenzoyl)amino]carbamothioyl]prop-2-enamide CAS Name: 3-(5-bromo-2-methoxyphenyl)-N-[[[(4-chlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(5-bromo-2-methoxyphenyl)-N-[[(4-chlorobenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: 3-(5-bromo-2-methoxy-phenyl)-N-[[(4-chlorobenzoyl)amino]thiocarbamoyl]acrylamide Formula: C18H15BrClN3O3S MolecularWeight: 468.752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C=CC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H15BrClN3O3S/c1-26-15-8-5-13(19)10-12(15)4-9-16(24)21-18(27)23-22-17(25)11-2-6-14(20)7-3-11/h2-10H,1H3,(H,22,25)(H2,21,23,24,27)