N-[2-cyanoethyl(pyridin-3-ylmethyl)carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: N-[2-cyanoethyl(pyridin-3-ylmethyl)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: N-[2-cyanoethyl(3-pyridylmethyl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: N-[[2-cyanoethyl(3-pyridinylmethyl)amino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: N-[2-cyanoethyl(pyridin-3-ylmethyl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: N-[2-cyanoethyl(3-pyridylmethyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(=S)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C=CC(=O)NC(=S)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C19H18N4OS/c20-11-5-13-23(15-17-8-4-12-21-14-17)19(25)22-18(24)10-9-16-6-2-1-3-7-16/h1-4,6-10,12,14H,5,13,15H2,(H,22,24,25)