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

Systemtic Name: (4E)-3-methyl-4-(phenylcarbamothioylhydrazinylidene)-N,N-bis(phenylmethyl)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-N,N-dibenzyl-3-methyl-4-(phenylcarbamothioylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-4-[[anilino(sulfanylidene)methyl]hydrazinylidene]-3-methyl-N,N-bis(phenylmethyl)-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-N,N-dibenzyl-3-methyl-4-(phenylcarbamothioylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-N,N-dibenzyl-3-methyl-4-(phenylthiocarbamoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C31H30N4O2S MolecularWeight: 522.6605

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=S)NC3=CC=CC=C3)CCC2)C(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=S)NC3=CC=CC=C3)/CCC2)C(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C31H30N4O2S/c1-22-28-26(33-34-31(38)32-25-16-9-4-10-17-25)18-11-19-27(28)37-29(22)30(36)35(20-23-12-5-2-6-13-23)21-24-14-7-3-8-15-24/h2-10,12-17H,11,18-21H2,1H3,(H2,32,34,38)/b33-26+