N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[(2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[(2-phenylbenzotriazol-5-yl)thiocarbamoyl]coumarilamide Formula: C22H15N5O2S MolecularWeight: 413.4518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C22H15N5O2S/c28-21(20-12-14-6-4-5-9-19(14)29-20)24-22(30)23-15-10-11-17-18(13-15)26-27(25-17)16-7-2-1-3-8-16/h1-13H,(H2,23,24,28,30)