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

Systemtic Name: (4E)-N-(1,3-benzodioxol-5-ylmethyl)-4-(carbamothioylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-N-(1,3-benzodioxol-5-ylmethyl)-4-(carbamothioylhydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-N-(1,3-benzodioxol-5-ylmethyl)-4-(carbamothioylhydrazinylidene)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-N-(1,3-benzodioxol-5-ylmethyl)-4-(carbamothioylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-3-methyl-N-piperonyl-4-(thiocarbamoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=S)N)CCC2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=S)N)/CCC2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H20N4O4S/c1-10-16-12(22-23-19(20)28)3-2-4-14(16)27-17(10)18(24)21-8-11-5-6-13-15(7-11)26-9-25-13/h5-7H,2-4,8-9H2,1H3,(H,21,24)(H3,20,23,28)/b22-12+