octyl (2S)-2-azanyl-4-methyl-4-[3-(2-methylimidazo[4,5-c]pyridin-1-yl)propylsulfonyl]pentanoate

Systemtic Name: octyl (2S)-2-azanyl-4-methyl-4-[3-(2-methylimidazo[4,5-c]pyridin-1-yl)propylsulfonyl]pentanoate Openeye Name: octyl (2S)-2-amino-4-methyl-4-[3-(2-methylimidazo[4,5-c]pyridin-1-yl)propylsulfonyl]pentanoate CAS Name: (2S)-2-amino-4-methyl-4-[3-(2-methyl-1-imidazo[4,5-c]pyridinyl)propylsulfonyl]pentanoic acid octyl ester IUPAC Name: octyl (2S)-2-amino-4-methyl-4-[3-(2-methylimidazo[4,5-c]pyridin-1-yl)propylsulfonyl]pentanoate Traditional Name: (2S)-2-amino-4-methyl-4-[3-(2-methylimidazo[4,5-c]pyridin-1-yl)propylsulfonyl]valeric acid octyl ester Formula: C24H40N4O4S MolecularWeight: 480.6638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CC(C)(C)S(=O)(=O)CCCN1C(=NC2=C1C=CN=C2)C)N

Isomeric SMILES

CCCCCCCCOC(=O)[C@H](CC(C)(C)S(=O)(=O)CCCN1C(=NC2=C1C=CN=C2)C)N

InChI

InChI=1S/C24H40N4O4S/c1-5-6-7-8-9-10-15-32-23(29)20(25)17-24(3,4)33(30,31)16-11-14-28-19(2)27-21-18-26-13-12-22(21)28/h12-13,18,20H,5-11,14-17,25H2,1-4H3/t20-/m0/s1