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

Systemtic Name: N-[1-(3-azanylpropylamino)-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-2,2-dimethyl-3-(phenylmethylsulfanyl)propanamide Openeye Name: N-[2-(3-aminopropylamino)-1-(benzylsulfanylmethyl)-2-oxo-ethyl]-3-benzylsulfanyl-2,2-dimethyl-propanamide CAS Name: N-[1-(3-aminopropylamino)-1-oxo-3-(phenylmethylthio)propan-2-yl]-2,2-dimethyl-3-(phenylmethylthio)propanamide IUPAC Name: N-[1-(3-aminopropylamino)-3-benzylsulfanyl-1-oxopropan-2-yl]-3-benzylsulfanyl-2,2-dimethylpropanamide Traditional Name: N-[2-(3-aminopropylamino)-1-[(benzylthio)methyl]-2-keto-ethyl]-3-(benzylthio)-2,2-dimethyl-propionamide Formula: C25H35N3O2S2 MolecularWeight: 473.6943

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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)NCCCN

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O2S2/c1-25(2,19-32-17-21-12-7-4-8-13-21)24(30)28-22(23(29)27-15-9-14-26)18-31-16-20-10-5-3-6-11-20/h3-8,10-13,22H,9,14-19,26H2,1-2H3,(H,27,29)(H,28,30)