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

Systemtic Name: (E)-N-[[(3-chlorophenyl)carbonylamino]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[[(3-chlorobenzoyl)amino]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[[(3-chlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[[(3-chlorobenzoyl)amino]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[[(3-chlorobenzoyl)amino]thiocarbamoyl]-3-(4-methoxyphenyl)acrylamide Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3O3S/c1-25-15-8-5-12(6-9-15)7-10-16(23)20-18(26)22-21-17(24)13-3-2-4-14(19)11-13/h2-11H,1H3,(H,21,24)(H2,20,22,23,26)/b10-7+