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

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[[(3-hydroxy-2-naphthoyl)amino]thiocarbamoyl]-3-(4-methoxyphenyl)acrylamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O

InChI

InChI=1S/C22H19N3O4S/c1-29-17-9-6-14(7-10-17)8-11-20(27)23-22(30)25-24-21(28)18-12-15-4-2-3-5-16(15)13-19(18)26/h2-13,26H,1H3,(H,24,28)(H2,23,25,27,30)/b11-8+