N-tert-butyl-2-[methyl-[[4-methyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]ethanamide

Systemtic Name: N-tert-butyl-2-[methyl-[[4-methyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]ethanamide Openeye Name: 2-[(3-benzyl-4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[methyl-[[4-methyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]acetamide IUPAC Name: 2-[(3-benzyl-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methylamino]-N-tert-butylacetamide Traditional Name: 2-[(3-benzyl-4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]-N-tert-butyl-acetamide Formula: C18H27N5OS MolecularWeight: 361.50488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)CN1C(=S)N(C(=N1)CC2=CC=CC=C2)C

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)CN1C(=S)N(C(=N1)CC2=CC=CC=C2)C

InChI

InChI=1S/C18H27N5OS/c1-18(2,3)19-16(24)12-21(4)13-23-17(25)22(5)15(20-23)11-14-9-7-6-8-10-14/h6-10H,11-13H2,1-5H3,(H,19,24)