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

Systemtic Name: (4E)-4-(carbamothioylhydrazinylidene)-N-(3-chloranyl-2-methyl-phenyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-4-(carbamothioylhydrazono)-N-(3-chloro-2-methyl-phenyl)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-4-(carbamothioylhydrazinylidene)-N-(3-chloro-2-methylphenyl)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-4-(carbamothioylhydrazinylidene)-N-(3-chloro-2-methylphenyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-N-(3-chloro-2-methyl-phenyl)-3-methyl-4-(thiocarbamoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C18H19ClN4O2S MolecularWeight: 390.88706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C3=C(O2)CCCC3=NNC(=S)N)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C\3=C(O2)CCC/C3=N\NC(=S)N)C

InChI

InChI=1S/C18H19ClN4O2S/c1-9-11(19)5-3-6-12(9)21-17(24)16-10(2)15-13(22-23-18(20)26)7-4-8-14(15)25-16/h3,5-6H,4,7-8H2,1-2H3,(H,21,24)(H3,20,23,26)/b22-13+