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

Systemtic Name: (E)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-3-(5-phenyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[[(6-methyl-2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(6-methyl-2-phenylbenzotriazol-5-yl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)thiocarbamoyl]-3-(5-phenyl-2-furyl)acrylamide Formula: C27H21N5O2S MolecularWeight: 479.55294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C=CC3=CC=C(O3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)/C=C/C3=CC=C(O3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H21N5O2S/c1-18-16-23-24(31-32(30-23)20-10-6-3-7-11-20)17-22(18)28-27(35)29-26(33)15-13-21-12-14-25(34-21)19-8-4-2-5-9-19/h2-17H,1H3,(H2,28,29,33,35)/b15-13+