3-(1,3-dithian-2-yl)-4-methyl-5-phenyl-1,2,4-triazole

Systemtic Name: 3-(1,3-dithian-2-yl)-4-methyl-5-phenyl-1,2,4-triazole Openeye Name: 3-(1,3-dithian-2-yl)-4-methyl-5-phenyl-1,2,4-triazole CAS Name: 3-(1,3-dithian-2-yl)-4-methyl-5-phenyl-1,2,4-triazole IUPAC Name: 3-(1,3-dithian-2-yl)-4-methyl-5-phenyl-1,2,4-triazole Traditional Name: 3-(1,3-dithian-2-yl)-4-methyl-5-phenyl-1,2,4-triazole Formula: C13H15N3S2 MolecularWeight: 277.4083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1C2=CC=CC=C2)C3SCCCS3

Isomeric SMILES

CN1C(=NN=C1C2=CC=CC=C2)C3SCCCS3

InChI

InChI=1S/C13H15N3S2/c1-16-11(10-6-3-2-4-7-10)14-15-12(16)13-17-8-5-9-18-13/h2-4,6-7,13H,5,8-9H2,1H3