2-(1,3-benzothiazol-2-yl)-5-methyl-5-(5-methyl-1,3-dioxan-5-yl)-1,2,4-triazolidine-3-thione

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-5-(5-methyl-1,3-dioxan-5-yl)-1,2,4-triazolidine-3-thione Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-5-(5-methyl-1,3-dioxan-5-yl)-1,2,4-triazolidine-3-thione CAS Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-5-(5-methyl-1,3-dioxan-5-yl)-1,2,4-triazolidine-3-thione IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-5-(5-methyl-1,3-dioxan-5-yl)-1,2,4-triazolidine-3-thione Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-methyl-5-(5-methyl-1,3-dioxan-5-yl)-1,2,4-triazolidine-3-thione Formula: C15H18N4O2S2 MolecularWeight: 350.45902

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COCOC1)C2(NC(=S)N(N2)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1(COCOC1)C2(NC(=S)N(N2)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C15H18N4O2S2/c1-14(7-20-9-21-8-14)15(2)17-12(22)19(18-15)13-16-10-5-3-4-6-11(10)23-13/h3-6,18H,7-9H2,1-2H3,(H,17,22)