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

Systemtic Name: 5-(furan-2-yl)-4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 5-(2-furyl)-4-methyl-2-[(2-methyl-5-nitro-indolin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-(2-furanyl)-4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 5-(furan-2-yl)-4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 5-(2-furyl)-4-methyl-2-[(2-methyl-5-nitro-indolin-1-yl)methyl]-1,2,4-triazole-3-thione Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1CN3C(=S)N(C(=N3)C4=CC=CO4)C)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CC2=C(N1CN3C(=S)N(C(=N3)C4=CC=CO4)C)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O3S/c1-11-8-12-9-13(22(23)24)5-6-14(12)20(11)10-21-17(26)19(2)16(18-21)15-4-3-7-25-15/h3-7,9,11H,8,10H2,1-2H3