[4-(1,3-dithiolan-2-yl)phenyl] 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C19H17N3O2S2 MolecularWeight: 383.48718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OC2=CC=C(C=C2)C3SCCS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)OC2=CC=C(C=C2)C3SCCS3)C4=CC=CC=C4

InChI

InChI=1S/C19H17N3O2S2/c1-13-17(21-22(20-13)15-5-3-2-4-6-15)18(23)24-16-9-7-14(8-10-16)19-25-11-12-26-19/h2-10,19H,11-12H2,1H3