4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-1,2,4-triazole-3-thiolate Formula: C18H14BrN4S- MolecularWeight: 398.29956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3C4=CC=C(C=C4)Br)[S-])C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3C4=CC=C(C=C4)Br)[S-])C

InChI

InChI=1S/C18H15BrN4S/c1-10-11(2)20-16-8-3-12(9-15(10)16)17-21-22-18(24)23(17)14-6-4-13(19)5-7-14/h3-9,20H,1-2H3,(H,22,24)/p-1