3-methyl-4-[3-(2-methyl-5-nitro-imidazol-1-yl)propylsulfanyl]-2-(pyridin-4-ylsulfanylmethyl)pyridine

Systemtic Name: 3-methyl-4-[3-(2-methyl-5-nitro-imidazol-1-yl)propylsulfanyl]-2-(pyridin-4-ylsulfanylmethyl)pyridine Openeye Name: 3-methyl-4-[3-(2-methyl-5-nitro-imidazol-1-yl)propylsulfanyl]-2-(4-pyridylsulfanylmethyl)pyridine CAS Name: 3-methyl-4-[3-(2-methyl-5-nitro-1-imidazolyl)propylthio]-2-[(pyridin-4-ylthio)methyl]pyridine IUPAC Name: 3-methyl-4-[3-(2-methyl-5-nitroimidazol-1-yl)propylsulfanyl]-2-(pyridin-4-ylsulfanylmethyl)pyridine Traditional Name: 3-methyl-4-[3-(2-methyl-5-nitro-imidazol-1-yl)propylthio]-2-[(4-pyridylthio)methyl]pyridine Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=CC=NC=C2)SCCCN3C(=NC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=CN=C1CSC2=CC=NC=C2)SCCCN3C(=NC=C3[N+](=O)[O-])C

InChI

InChI=1S/C19H21N5O2S2/c1-14-17(13-28-16-4-7-20-8-5-16)21-9-6-18(14)27-11-3-10-23-15(2)22-12-19(23)24(25)26/h4-9,12H,3,10-11,13H2,1-2H3