N-[3-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[3-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[3-[2-(4-butoxyanilino)-2-oxo-ethyl]sulfanylphenyl]cyclohexanecarboxamide CAS Name: N-[3-[[2-(4-butoxyanilino)-2-oxoethyl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[3-[2-(4-butoxyanilino)-2-oxoethyl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[3-[[2-(4-butoxyanilino)-2-keto-ethyl]thio]phenyl]cyclohexanecarboxamide Formula: C25H32N2O3S MolecularWeight: 440.59818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C25H32N2O3S/c1-2-3-16-30-22-14-12-20(13-15-22)26-24(28)18-31-23-11-7-10-21(17-23)27-25(29)19-8-5-4-6-9-19/h7,10-15,17,19H,2-6,8-9,16,18H2,1H3,(H,26,28)(H,27,29)