(E)-3-phenyl-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[(1-benzyl-4-piperidyl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-3-phenyl-N-[[[1-(phenylmethyl)-4-piperidinyl]amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-N-[(1-benzylpiperidin-4-yl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[(1-benzyl-4-piperidyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=S)NC(=O)C=CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=S)NC(=O)/C=C/C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3OS/c26-21(12-11-18-7-3-1-4-8-18)24-22(27)23-20-13-15-25(16-14-20)17-19-9-5-2-6-10-19/h1-12,20H,13-17H2,(H2,23,24,26,27)/b12-11+