N-(2,3-dihydro-1H-inden-5-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-indan-5-yl-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-indan-5-yl-4-(methylthio)-2-(tosylamino)butyramide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H26N2O3S2/c1-15-6-10-19(11-7-15)28(25,26)23-20(12-13-27-2)21(24)22-18-9-8-16-4-3-5-17(16)14-18/h6-11,14,20,23H,3-5,12-13H2,1-2H3,(H,22,24)