3-methyl-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-methyl-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: 3-methyl-N-[[2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]benzofuran-2-carboxamide CAS Name: 3-methyl-N-[[[2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: 3-methyl-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-N-[[2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]coumarilamide Formula: C27H19N5O2S MolecularWeight: 477.53706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C27H19N5O2S/c1-16-19-9-4-5-12-24(19)34-25(16)26(33)29-27(35)28-18-13-14-21-22(15-18)31-32(30-21)23-11-6-8-17-7-2-3-10-20(17)23/h2-15H,1H3,(H2,28,29,33,35)