(E)-3-[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]-N-(pyridin-3-ylcarbamothioyl)prop-2-enamide

Systemtic Name: (E)-3-[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]-N-(pyridin-3-ylcarbamothioyl)prop-2-enamide Openeye Name: (E)-3-[5-(3-chloro-4-methyl-phenyl)-2-furyl]-N-(3-pyridylcarbamothioyl)prop-2-enamide CAS Name: (E)-3-[5-(3-chloro-4-methylphenyl)-2-furanyl]-N-[(3-pyridinylamino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-[5-(3-chloro-4-methylphenyl)furan-2-yl]-N-(pyridin-3-ylcarbamothioyl)prop-2-enamide Traditional Name: (E)-3-[5-(3-chloro-4-methyl-phenyl)-2-furyl]-N-(3-pyridylthiocarbamoyl)acrylamide Formula: C20H16ClN3O2S MolecularWeight: 397.87794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C=CC(=O)NC(=S)NC3=CN=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)/C=C/C(=O)NC(=S)NC3=CN=CC=C3)Cl

InChI

InChI=1S/C20H16ClN3O2S/c1-13-4-5-14(11-17(13)21)18-8-6-16(26-18)7-9-19(25)24-20(27)23-15-3-2-10-22-12-15/h2-12H,1H3,(H2,23,24,25,27)/b9-7+