N-(4-methoxyphenyl)-3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: N-(4-methoxyphenyl)-3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-(4-methoxyphenyl)-3-[(2-methylthiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: N-(4-methoxyphenyl)-3-[(2-methyl-4-thiazolyl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: N-(4-methoxyphenyl)-3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: (4-methoxyphenyl)-[3-[(2-methylthiazol-4-yl)methylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C14H15N5OS2 MolecularWeight: 333.4318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=NNC(=N2)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NC(=CS1)CSC2=NNC(=N2)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C14H15N5OS2/c1-9-15-11(7-21-9)8-22-14-17-13(18-19-14)16-10-3-5-12(20-2)6-4-10/h3-7H,8H2,1-2H3,(H2,16,17,18,19)