(E)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[(6-methyl-2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[(6-methyl-2-phenylbenzotriazol-5-yl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C23H19N5OS MolecularWeight: 413.49486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C=CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)/C=C/C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N5OS/c1-16-14-20-21(27-28(26-20)18-10-6-3-7-11-18)15-19(16)24-23(30)25-22(29)13-12-17-8-4-2-5-9-17/h2-15H,1H3,(H2,24,25,29,30)/b13-12+