N-(4-butylphenyl)-3-[3-[(4-butylphenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide

Systemtic Name: N-(4-butylphenyl)-3-[3-[(4-butylphenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide Openeye Name: 3-[3-(4-butylanilino)-3-oxo-propyl]sulfanyl-N-(4-butylphenyl)propanamide CAS Name: 3-[[3-(4-butylanilino)-3-oxopropyl]thio]-N-(4-butylphenyl)propanamide IUPAC Name: 3-[3-(4-butylanilino)-3-oxopropyl]sulfanyl-N-(4-butylphenyl)propanamide Traditional Name: 3-[[3-(4-butylanilino)-3-keto-propyl]thio]-N-(4-butylphenyl)propionamide Formula: C26H36N2O2S MolecularWeight: 440.64124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCSCCC(=O)NC2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCSCCC(=O)NC2=CC=C(C=C2)CCCC

InChI

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