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

Systemtic Name: N-(4-methoxyphenyl)-4-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazol-2-amine Openeye Name: N-(4-methoxyphenyl)-4-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]thiazol-2-amine CAS Name: N-(4-methoxyphenyl)-4-[[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]methyl]-2-thiazolamine IUPAC Name: N-(4-methoxyphenyl)-4-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazol-2-amine Traditional Name: (4-methoxyphenyl)-[4-[[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]methyl]thiazol-2-yl]amine Formula: C17H15N5OS3 MolecularWeight: 401.5289

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NNC(=N3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NNC(=N3)C4=CC=CS4

InChI

InChI=1S/C17H15N5OS3/c1-23-13-6-4-11(5-7-13)18-16-19-12(9-25-16)10-26-17-20-15(21-22-17)14-3-2-8-24-14/h2-9H,10H2,1H3,(H,18,19)(H,20,21,22)