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

Systemtic Name: (E)-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-3-(2-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-3-(2-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(2-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-3-(2-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]-3-(2-methoxyphenyl)acrylamide Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C=CC2=CC=CC=C2OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=CC=C2OC

InChI

InChI=1S/C24H29N3O4S/c1-3-4-5-8-17-31-20-14-11-19(12-15-20)23(29)26-27-24(32)25-22(28)16-13-18-9-6-7-10-21(18)30-2/h6-7,9-16H,3-5,8,17H2,1-2H3,(H,26,29)(H2,25,27,28,32)/b16-13+