(E)-N-[(2-chloranylpyridin-3-yl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2-chloranylpyridin-3-yl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-N-[(2-chloro-3-pyridyl)carbamothioyl]-3-(4-isopropylphenyl)prop-2-enamide CAS Name: (E)-N-[[(2-chloro-3-pyridinyl)amino]-sulfanylidenemethyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-[(2-chloropyridin-3-yl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-[(2-chloro-3-pyridyl)thiocarbamoyl]-3-p-cumenyl-acrylamide Formula: C18H18ClN3OS MolecularWeight: 359.87302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=C(N=CC=C2)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=C(N=CC=C2)Cl

InChI

InChI=1S/C18H18ClN3OS/c1-12(2)14-8-5-13(6-9-14)7-10-16(23)22-18(24)21-15-4-3-11-20-17(15)19/h3-12H,1-2H3,(H2,21,22,23,24)/b10-7+