(E)-3-(4-methoxyphenyl)-N-[(4-methylphenyl)-(4-oxidanylbutyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-[(4-methylphenyl)-(4-oxidanylbutyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[4-hydroxybutyl(p-tolyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[N-(4-hydroxybutyl)-4-methylanilino]-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[4-hydroxybutyl-(4-methylphenyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[4-hydroxybutyl(p-tolyl)thiocarbamoyl]-3-(4-methoxyphenyl)acrylamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCCCO)C(=S)NC(=O)C=CC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)N(CCCCO)C(=S)NC(=O)/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C22H26N2O3S/c1-17-5-10-19(11-6-17)24(15-3-4-16-25)22(28)23-21(26)14-9-18-7-12-20(27-2)13-8-18/h5-14,25H,3-4,15-16H2,1-2H3,(H,23,26,28)/b14-9+