(2S,3S)-2-azanyl-3-methyl-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)pentanamide

Systemtic Name: (2S,3S)-2-azanyl-3-methyl-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)pentanamide Openeye Name: (2S,3S)-2-amino-3-methyl-N-(1-methylsulfonylindolin-5-yl)pentanamide CAS Name: (2S,3S)-2-amino-3-methyl-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)pentanamide IUPAC Name: (2S,3S)-2-amino-3-methyl-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)pentanamide Traditional Name: (2S,3S)-2-amino-N-(1-mesylindolin-5-yl)-3-methyl-valeramide Formula: C15H23N3O3S MolecularWeight: 325.42642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC2=C(C=C1)N(CC2)S(=O)(=O)C)N

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O3S/c1-4-10(2)14(16)15(19)17-12-5-6-13-11(9-12)7-8-18(13)22(3,20)21/h5-6,9-10,14H,4,7-8,16H2,1-3H3,(H,17,19)/t10-,14-/m0/s1