1-tert-butyl-3-[3-[(4-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]urea

Systemtic Name: 1-tert-butyl-3-[3-[(4-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]urea Openeye Name: 1-tert-butyl-3-[3-[(4-methoxyphenyl)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]urea CAS Name: 1-tert-butyl-3-[3-[(4-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]urea IUPAC Name: 1-tert-butyl-3-[3-[(4-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]urea Traditional Name: 1-tert-butyl-3-(3-p-anisyl-5-thioxo-1H-1,2,4-triazol-4-yl)urea Formula: C15H21N5O2S MolecularWeight: 335.42454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NN1C(=NNC1=S)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)NC(=O)NN1C(=NNC1=S)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H21N5O2S/c1-15(2,3)16-13(21)19-20-12(17-18-14(20)23)9-10-5-7-11(22-4)8-6-10/h5-8H,9H2,1-4H3,(H,18,23)(H2,16,19,21)