(E)-3-(3,4-dimethoxyphenyl)-N-[(phenylcarbamoylamino)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(phenylcarbamoylamino)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(phenylcarbamoylamino)carbamothioyl]prop-2-enamide CAS Name: (E)-N-[[[anilino(oxo)methyl]hydrazo]-sulfanylidenemethyl]-3-(3,4-dimethoxyphenyl)-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(phenylcarbamoylamino)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(phenylcarbamoylamino)thiocarbamoyl]acrylamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC(=S)NNC(=O)NC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)NC2=CC=CC=C2)OC

InChI

InChI=1S/C19H20N4O4S/c1-26-15-10-8-13(12-16(15)27-2)9-11-17(24)21-19(28)23-22-18(25)20-14-6-4-3-5-7-14/h3-12H,1-2H3,(H2,20,22,25)(H2,21,23,24,28)/b11-9+