(E)-3-(furan-2-yl)-N-[[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(furan-2-yl)-N-[[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-furyl)-N-[[6-methyl-2-(p-tolyl)benzotriazol-5-yl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-furanyl)-N-[[[6-methyl-2-(4-methylphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(furan-2-yl)-N-[[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-furyl)-N-[[6-methyl-2-(p-tolyl)benzotriazol-5-yl]thiocarbamoyl]acrylamide Formula: C22H19N5O2S MolecularWeight: 417.48356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C=CC4=CC=CO4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)/C=C/C4=CC=CO4)C

InChI

InChI=1S/C22H19N5O2S/c1-14-5-7-16(8-6-14)27-25-19-12-15(2)18(13-20(19)26-27)23-22(30)24-21(28)10-9-17-4-3-11-29-17/h3-13H,1-2H3,(H2,23,24,28,30)/b10-9+