(4E)-3-methyl-N-(4-methylpiperazin-1-yl)-4-(phenylcarbamothioylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxamide

Systemtic Name: (4E)-3-methyl-N-(4-methylpiperazin-1-yl)-4-(phenylcarbamothioylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-3-methyl-N-(4-methylpiperazin-1-yl)-4-(phenylcarbamothioylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-4-[[anilino(sulfanylidene)methyl]hydrazinylidene]-3-methyl-N-(4-methyl-1-piperazinyl)-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-3-methyl-N-(4-methylpiperazin-1-yl)-4-(phenylcarbamothioylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-3-methyl-N-(4-methylpiperazino)-4-(phenylthiocarbamoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C22H28N6O2S MolecularWeight: 440.56172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=S)NC3=CC=CC=C3)CCC2)C(=O)NN4CCN(CC4)C

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=S)NC3=CC=CC=C3)/CCC2)C(=O)NN4CCN(CC4)C

InChI

InChI=1S/C22H28N6O2S/c1-15-19-17(24-25-22(31)23-16-7-4-3-5-8-16)9-6-10-18(19)30-20(15)21(29)26-28-13-11-27(2)12-14-28/h3-5,7-8H,6,9-14H2,1-2H3,(H,26,29)(H2,23,25,31)/b24-17+