N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-methylsulfanyl-butanoic acid

Systemtic Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-methylsulfanyl-butanoic acid Openeye Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-methylsulfanyl-butanoic acid CAS Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-(methylthio)butanoic acid IUPAC Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-methylsulfanylbutanoic acid Traditional Name: dicyclohexylamine; 2-(diphenylthiophosphorylamino)-4-(methylthio)butyric acid Formula: C29H43N2O2PS2 MolecularWeight: 546.767681

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NP(=S)(C1=CC=CC=C1)C2=CC=CC=C2.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

CSCCC(C(=O)O)NP(=S)(C1=CC=CC=C1)C2=CC=CC=C2.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C17H20NO2PS2.C12H23N/c1-23-13-12-16(17(19)20)18-21(22,14-8-4-2-5-9-14)15-10-6-3-7-11-15;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h2-11,16H,12-13H2,1H3,(H,18,22)(H,19,20);11-13H,1-10H2