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

Systemtic Name: 4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-5-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-benzyl-4-methyl-2-[(2-methyl-5-nitro-indolin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-5-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-benzyl-4-methyl-2-[(2-methyl-5-nitro-2,3-dihydroindol-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 5-benzyl-4-methyl-2-[(2-methyl-5-nitro-indolin-1-yl)methyl]-1,2,4-triazole-3-thione Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1CN3C(=S)N(C(=N3)CC4=CC=CC=C4)C)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CC2=C(N1CN3C(=S)N(C(=N3)CC4=CC=CC=C4)C)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O2S/c1-14-10-16-12-17(25(26)27)8-9-18(16)23(14)13-24-20(28)22(2)19(21-24)11-15-6-4-3-5-7-15/h3-9,12,14H,10-11,13H2,1-2H3