4-[2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioyl]hydrazinyl]-4-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 4-[2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioyl]hydrazinyl]-4-oxidanylidene-N-phenyl-butanamide Openeye Name: 4-[2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioyl]hydrazino]-4-oxo-N-phenyl-butanamide CAS Name: 4-[[[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]hydrazo]-4-oxo-N-phenylbutanamide IUPAC Name: 4-[2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioyl]hydrazinyl]-4-oxo-N-phenylbutanamide Traditional Name: 4-keto-4-[N'-[[(E)-3-(4-methoxyphenyl)acryloyl]thiocarbamoyl]hydrazino]-N-phenyl-butyramide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4S/c1-29-17-10-7-15(8-11-17)9-12-19(27)23-21(30)25-24-20(28)14-13-18(26)22-16-5-3-2-4-6-16/h2-12H,13-14H2,1H3,(H,22,26)(H,24,28)(H2,23,25,27,30)/b12-9+