N-[3-[methyl-(phenylmethyl)amino]propyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-[3-[methyl-(phenylmethyl)amino]propyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-[3-[methyl-(phenylmethyl)amino]propyl]-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-4-(methylthio)-2-(tosylamino)butyramide Formula: C23H33N3O3S2 MolecularWeight: 463.65642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCCCN(C)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCCCN(C)CC2=CC=CC=C2

InChI

InChI=1S/C23H33N3O3S2/c1-19-10-12-21(13-11-19)31(28,29)25-22(14-17-30-3)23(27)24-15-7-16-26(2)18-20-8-5-4-6-9-20/h4-6,8-13,22,25H,7,14-18H2,1-3H3,(H,24,27)