N-[1-(5-azanylpentylamino)-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-2,2-dimethyl-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[1-(5-azanylpentylamino)-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-2,2-dimethyl-3-(phenylmethylsulfanyl)propanamide Openeye Name: N-[2-(5-aminopentylamino)-1-(benzylsulfanylmethyl)-2-oxo-ethyl]-3-benzylsulfanyl-2,2-dimethyl-propanamide CAS Name: N-[1-(5-aminopentylamino)-1-oxo-3-(phenylmethylthio)propan-2-yl]-2,2-dimethyl-3-(phenylmethylthio)propanamide IUPAC Name: N-[1-(5-aminopentylamino)-3-benzylsulfanyl-1-oxopropan-2-yl]-3-benzylsulfanyl-2,2-dimethylpropanamide Traditional Name: N-[2-(5-aminopentylamino)-1-[(benzylthio)methyl]-2-keto-ethyl]-3-(benzylthio)-2,2-dimethyl-propionamide Formula: C27H39N3O2S2 MolecularWeight: 501.74746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CSCC1=CC=CC=C1)C(=O)NC(CSCC2=CC=CC=C2)C(=O)NCCCCCN

Isomeric SMILES

CC(C)(CSCC1=CC=CC=C1)C(=O)NC(CSCC2=CC=CC=C2)C(=O)NCCCCCN

InChI

InChI=1S/C27H39N3O2S2/c1-27(2,21-34-19-23-14-8-4-9-15-23)26(32)30-24(25(31)29-17-11-5-10-16-28)20-33-18-22-12-6-3-7-13-22/h3-4,6-9,12-15,24H,5,10-11,16-21,28H2,1-2H3,(H,29,31)(H,30,32)