5-(3,4-dimethylphenyl)-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3,4-dimethylphenyl)-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-N-[[2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-N-[[[2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-N-[[2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]-2-furamide Formula: C30H23N5O2S MolecularWeight: 517.60092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3)C5=CC=CC6=CC=CC=C65)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3)C5=CC=CC6=CC=CC=C65)C

InChI

InChI=1S/C30H23N5O2S/c1-18-10-11-21(16-19(18)2)27-14-15-28(37-27)29(36)32-30(38)31-22-12-13-24-25(17-22)34-35(33-24)26-9-5-7-20-6-3-4-8-23(20)26/h3-17H,1-2H3,(H2,31,32,36,38)