(2S,3S)-2-azanyl-3-methyl-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)pentanamide

Systemtic Name: (2S,3S)-2-azanyl-3-methyl-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)pentanamide Openeye Name: (2S,3S)-2-amino-3-methyl-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)pentanamide CAS Name: (2S,3S)-2-amino-3-methyl-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)pentanamide IUPAC Name: (2S,3S)-2-amino-3-methyl-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)pentanamide Traditional Name: (2S,3S)-2-amino-N-(1-mesyl-3,4-dihydro-2H-quinolin-7-yl)-3-methyl-valeramide Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC2=C(CCCN2S(=O)(=O)C)C=C1)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC1=CC2=C(CCCN2S(=O)(=O)C)C=C1)N

InChI

InChI=1S/C16H25N3O3S/c1-4-11(2)15(17)16(20)18-13-8-7-12-6-5-9-19(14(12)10-13)23(3,21)22/h7-8,10-11,15H,4-6,9,17H2,1-3H3,(H,18,20)/t11-,15-/m0/s1