N-[3-[1-(naphthalen-2-ylamino)-1-oxidanylidene-butan-2-yl]sulfanylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[3-[1-(naphthalen-2-ylamino)-1-oxidanylidene-butan-2-yl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[3-[1-(2-naphthylcarbamoyl)propylsulfanyl]phenyl]cyclohexanecarboxamide CAS Name: N-[3-[[1-(2-naphthalenylamino)-1-oxobutan-2-yl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[3-[1-(naphthalen-2-ylamino)-1-oxobutan-2-yl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[3-[1-(2-naphthylcarbamoyl)propylthio]phenyl]cyclohexanecarboxamide Formula: C27H30N2O2S MolecularWeight: 446.6043

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=CC=CC=C2C=C1)SC3=CC=CC(=C3)NC(=O)C4CCCCC4

Isomeric SMILES

CCC(C(=O)NC1=CC2=CC=CC=C2C=C1)SC3=CC=CC(=C3)NC(=O)C4CCCCC4

InChI

InChI=1S/C27H30N2O2S/c1-2-25(27(31)29-23-16-15-19-9-6-7-12-21(19)17-23)32-24-14-8-13-22(18-24)28-26(30)20-10-4-3-5-11-20/h6-9,12-18,20,25H,2-5,10-11H2,1H3,(H,28,30)(H,29,31)