(2S)-2-azanyl-3-methyl-N-(1-methylsulfonyl-2,3-dihydroindol-6-yl)butanamide

Systemtic Name: (2S)-2-azanyl-3-methyl-N-(1-methylsulfonyl-2,3-dihydroindol-6-yl)butanamide Openeye Name: (2S)-2-amino-3-methyl-N-(1-methylsulfonylindolin-6-yl)butanamide CAS Name: (2S)-2-amino-3-methyl-N-(1-methylsulfonyl-2,3-dihydroindol-6-yl)butanamide IUPAC Name: (2S)-2-amino-3-methyl-N-(1-methylsulfonyl-2,3-dihydroindol-6-yl)butanamide Traditional Name: (2S)-2-amino-N-(1-mesylindolin-6-yl)-3-methyl-butyramide Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC2=C(CCN2S(=O)(=O)C)C=C1)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC2=C(CCN2S(=O)(=O)C)C=C1)N

InChI

InChI=1S/C14H21N3O3S/c1-9(2)13(15)14(18)16-11-5-4-10-6-7-17(12(10)8-11)21(3,19)20/h4-5,8-9,13H,6-7,15H2,1-3H3,(H,16,18)/t13-/m0/s1