(2S)-3-methyl-N-(2-methyl-1H-indol-5-yl)-2-[(4-methylphenyl)sulfonylamino]butanamide

Systemtic Name: (2S)-3-methyl-N-(2-methyl-1H-indol-5-yl)-2-[(4-methylphenyl)sulfonylamino]butanamide Openeye Name: (2S)-3-methyl-N-(2-methyl-1H-indol-5-yl)-2-(p-tolylsulfonylamino)butanamide CAS Name: (2S)-3-methyl-N-(2-methyl-1H-indol-5-yl)-2-[(4-methylphenyl)sulfonylamino]butanamide IUPAC Name: (2S)-3-methyl-N-(2-methyl-1H-indol-5-yl)-2-[(4-methylphenyl)sulfonylamino]butanamide Traditional Name: (2S)-3-methyl-N-(2-methyl-1H-indol-5-yl)-2-(tosylamino)butyramide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NC2=CC3=C(C=C2)NC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)NC2=CC3=C(C=C2)NC(=C3)C

InChI

InChI=1S/C21H25N3O3S/c1-13(2)20(24-28(26,27)18-8-5-14(3)6-9-18)21(25)23-17-7-10-19-16(12-17)11-15(4)22-19/h5-13,20,22,24H,1-4H3,(H,23,25)/t20-/m0/s1