(E)-N-[[(4-chlorophenyl)carbonylamino]carbamothioyl]-3-(4-ethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[[(4-chlorophenyl)carbonylamino]carbamothioyl]-3-(4-ethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[[(4-chlorobenzoyl)amino]carbamothioyl]-3-(4-ethoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[[(4-chlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(4-ethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[[(4-chlorobenzoyl)amino]carbamothioyl]-3-(4-ethoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[[(4-chlorobenzoyl)amino]thiocarbamoyl]-3-p-phenetyl-acrylamide Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H18ClN3O3S/c1-2-26-16-10-3-13(4-11-16)5-12-17(24)21-19(27)23-22-18(25)14-6-8-15(20)9-7-14/h3-12H,2H2,1H3,(H,22,25)(H2,21,23,24,27)/b12-5+