(E)-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide

Systemtic Name: (E)-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide Openeye Name: (E)-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-3-(1-naphthyl)prop-2-enamide CAS Name: (E)-N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(1-naphthalenyl)-2-propenamide IUPAC Name: (E)-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide Traditional Name: (E)-N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]-3-(1-naphthyl)acrylamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C=CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C27H29N3O3S/c1-2-3-4-7-19-33-23-16-13-22(14-17-23)26(32)29-30-27(34)28-25(31)18-15-21-11-8-10-20-9-5-6-12-24(20)21/h5-6,8-18H,2-4,7,19H2,1H3,(H,29,32)(H2,28,30,31,34)/b18-15+