N-(2,6-diethylphenyl)-3-[3-[(2,6-diethylphenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide

Systemtic Name: N-(2,6-diethylphenyl)-3-[3-[(2,6-diethylphenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide Openeye Name: 3-[3-(2,6-diethylanilino)-3-oxo-propyl]sulfanyl-N-(2,6-diethylphenyl)propanamide CAS Name: 3-[[3-(2,6-diethylanilino)-3-oxopropyl]thio]-N-(2,6-diethylphenyl)propanamide IUPAC Name: 3-[3-(2,6-diethylanilino)-3-oxopropyl]sulfanyl-N-(2,6-diethylphenyl)propanamide Traditional Name: 3-[[3-(2,6-diethylanilino)-3-keto-propyl]thio]-N-(2,6-diethylphenyl)propionamide Formula: C26H36N2O2S MolecularWeight: 440.64124

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CCSCCC(=O)NC2=C(C=CC=C2CC)CC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CCSCCC(=O)NC2=C(C=CC=C2CC)CC

InChI

InChI=1S/C26H36N2O2S/c1-5-19-11-9-12-20(6-2)25(19)27-23(29)15-17-31-18-16-24(30)28-26-21(7-3)13-10-14-22(26)8-4/h9-14H,5-8,15-18H2,1-4H3,(H,27,29)(H,28,30)