(E)-3-(4-chlorophenyl)-N-[(6-methylpyridin-2-yl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-chlorophenyl)-N-[(6-methylpyridin-2-yl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-chlorophenyl)-N-[(6-methyl-2-pyridyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-chlorophenyl)-N-[[(6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-chlorophenyl)-N-[(6-methylpyridin-2-yl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-chlorophenyl)-N-[(6-methyl-2-pyridyl)thiocarbamoyl]acrylamide Formula: C16H14ClN3OS MolecularWeight: 331.81986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=NC(=CC=C1)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H14ClN3OS/c1-11-3-2-4-14(18-11)19-16(22)20-15(21)10-7-12-5-8-13(17)9-6-12/h2-10H,1H3,(H2,18,19,20,21,22)/b10-7+