2-[[3-methyl-4-[2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanyl]ethylsulfanyl]pyridin-2-yl]methyl]quinolin-3-amine

Systemtic Name: 2-[[3-methyl-4-[2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanyl]ethylsulfanyl]pyridin-2-yl]methyl]quinolin-3-amine Openeye Name: 2-[[3-methyl-4-[2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanyl]ethylsulfanyl]-2-pyridyl]methyl]quinolin-3-amine CAS Name: 2-[[3-methyl-4-[2-[2-(2-methyl-5-nitro-1-imidazolyl)ethylthio]ethylthio]-2-pyridinyl]methyl]-3-quinolinamine IUPAC Name: 2-[[3-methyl-4-[2-[2-(2-methyl-5-nitroimidazol-1-yl)ethylsulfanyl]ethylsulfanyl]pyridin-2-yl]methyl]quinolin-3-amine Traditional Name: [2-[[3-methyl-4-[2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylthio]ethylthio]-2-pyridyl]methyl]-3-quinolyl]amine Formula: C24H26N6O2S2 MolecularWeight: 494.63224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CC2=NC3=CC=CC=C3C=C2N)SCCSCCN4C(=NC=C4[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=CN=C1CC2=NC3=CC=CC=C3C=C2N)SCCSCCN4C(=NC=C4[N+](=O)[O-])C

InChI

InChI=1S/C24H26N6O2S2/c1-16-21(14-22-19(25)13-18-5-3-4-6-20(18)28-22)26-8-7-23(16)34-12-11-33-10-9-29-17(2)27-15-24(29)30(31)32/h3-8,13,15H,9-12,14,25H2,1-2H3