(E)-3-(2-methoxyphenyl)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(2-methoxyphenyl)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-methoxyphenyl)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-methoxyphenyl)-N-[[4-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(2-methoxyphenyl)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-methoxyphenyl)-N-[[4-(3-phenylpropoxy)phenyl]thiocarbamoyl]acrylamide Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

InChI

InChI=1S/C26H26N2O3S/c1-30-24-12-6-5-11-21(24)13-18-25(29)28-26(32)27-22-14-16-23(17-15-22)31-19-7-10-20-8-3-2-4-9-20/h2-6,8-9,11-18H,7,10,19H2,1H3,(H2,27,28,29,32)/b18-13+