(E)-N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3-(5-phenyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[[[2-(4-butylphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[[2-(4-butylphenyl)benzotriazol-5-yl]thiocarbamoyl]-3-(5-phenyl-2-furyl)acrylamide Formula: C30H27N5O2S MolecularWeight: 521.63268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C=CC4=CC=C(O4)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)/C=C/C4=CC=C(O4)C5=CC=CC=C5

InChI

InChI=1S/C30H27N5O2S/c1-2-3-7-21-10-13-24(14-11-21)35-33-26-17-12-23(20-27(26)34-35)31-30(38)32-29(36)19-16-25-15-18-28(37-25)22-8-5-4-6-9-22/h4-6,8-20H,2-3,7H2,1H3,(H2,31,32,36,38)/b19-16+