(4E)-4-(carbamothioylhydrazinylidene)-3-methyl-N-(4-phenyldiazenylphenyl)-6,7-dihydro-5H-1-benzofuran-2-carboxamide

Systemtic Name: (4E)-4-(carbamothioylhydrazinylidene)-3-methyl-N-(4-phenyldiazenylphenyl)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-4-(carbamothioylhydrazono)-3-methyl-N-(4-phenylazophenyl)-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-4-(carbamothioylhydrazinylidene)-3-methyl-N-(4-phenyldiazenylphenyl)-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-4-(carbamothioylhydrazinylidene)-3-methyl-N-(4-phenyldiazenylphenyl)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-3-methyl-N-(4-phenylazophenyl)-4-(thiocarbamoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C23H22N6O2S MolecularWeight: 446.52478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=S)N)CCC2)C(=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=S)N)/CCC2)C(=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4

InChI

InChI=1S/C23H22N6O2S/c1-14-20-18(28-29-23(24)32)8-5-9-19(20)31-21(14)22(30)25-15-10-12-17(13-11-15)27-26-16-6-3-2-4-7-16/h2-4,6-7,10-13H,5,8-9H2,1H3,(H,25,30)(H3,24,29,32)/b27-26?,28-18+