4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 4-methyl-2-[(2-methyl-5-nitro-indolin-1-yl)methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 4-methyl-2-[(2-methyl-5-nitro-indolin-1-yl)methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C18H18N6O2S MolecularWeight: 382.43952

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1CN3C(=S)N(C(=N3)C4=CN=CC=C4)C)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CC2=C(N1CN3C(=S)N(C(=N3)C4=CN=CC=C4)C)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O2S/c1-12-8-14-9-15(24(25)26)5-6-16(14)22(12)11-23-18(27)21(2)17(20-23)13-4-3-7-19-10-13/h3-7,9-10,12H,8,11H2,1-2H3