(E)-N-[(4-heptoxyphenyl)carbamothioyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[(4-heptoxyphenyl)carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[(4-heptoxyphenyl)carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[(4-heptoxyanilino)-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[(4-heptoxyphenyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[(4-heptoxyphenyl)thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C21H26N2O2S2 MolecularWeight: 402.57334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=CS2

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C21H26N2O2S2/c1-2-3-4-5-6-15-25-18-11-9-17(10-12-18)22-21(26)23-20(24)14-13-19-8-7-16-27-19/h7-14,16H,2-6,15H2,1H3,(H2,22,23,24,26)/b14-13+