2-[[1-(2,6-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-3-methyl-quinoxaline

Systemtic Name: 2-[[1-(2,6-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-3-methyl-quinoxaline Openeye Name: 2-[[1-(2,6-dimethylphenyl)tetrazol-5-yl]sulfanylmethyl]-3-methyl-quinoxaline CAS Name: 2-[[[1-(2,6-dimethylphenyl)-5-tetrazolyl]thio]methyl]-3-methylquinoxaline IUPAC Name: 2-[[1-(2,6-dimethylphenyl)tetrazol-5-yl]sulfanylmethyl]-3-methylquinoxaline Traditional Name: 2-[[[1-(2,6-dimethylphenyl)tetrazol-5-yl]thio]methyl]-3-methyl-quinoxaline Formula: C19H18N6S MolecularWeight: 362.45142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SCC3=NC4=CC=CC=C4N=C3C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SCC3=NC4=CC=CC=C4N=C3C

InChI

InChI=1S/C19H18N6S/c1-12-7-6-8-13(2)18(12)25-19(22-23-24-25)26-11-17-14(3)20-15-9-4-5-10-16(15)21-17/h4-10H,11H2,1-3H3