2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]butanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]butanamide Openeye Name: N-[[4-(isopropylcarbamoylamino)phenyl]methyl]-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]butanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]butanamide Traditional Name: N-[4-(isopropylcarbamoylamino)benzyl]-4-(methylthio)-2-(tosylamino)butyramide Formula: C23H32N4O4S2 MolecularWeight: 492.65458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C

InChI

InChI=1S/C23H32N4O4S2/c1-16(2)25-23(29)26-19-9-7-18(8-10-19)15-24-22(28)21(13-14-32-4)27-33(30,31)20-11-5-17(3)6-12-20/h5-12,16,21,27H,13-15H2,1-4H3,(H,24,28)(H2,25,26,29)