(4Z)-4-(carbamothioylhydrazinylidene)-N-(4-ethylphenyl)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: (4Z)-4-(carbamothioylhydrazinylidene)-N-(4-ethylphenyl)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxamide Openeye Name: (4Z)-4-(carbamothioylhydrazono)-N-(4-ethylphenyl)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxamide CAS Name: (4Z)-4-(carbamothioylhydrazinylidene)-N-(4-ethylphenyl)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxamide IUPAC Name: (4Z)-4-(carbamothioylhydrazinylidene)-N-(4-ethylphenyl)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxamide Traditional Name: (4Z)-N-(4-ethylphenyl)-3,6,6-trimethyl-4-(thiocarbamoylhydrazono)-5,7-dihydrobenzofuran-2-carboxamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(O2)CC(CC3=NNC(=S)N)(C)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C\3=C(O2)CC(C/C3=N/NC(=S)N)(C)C)C

InChI

InChI=1S/C21H26N4O2S/c1-5-13-6-8-14(9-7-13)23-19(26)18-12(2)17-15(24-25-20(22)28)10-21(3,4)11-16(17)27-18/h6-9H,5,10-11H2,1-4H3,(H,23,26)(H3,22,25,28)/b24-15-