2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]-4-quinazolinamine IUPAC Name: 2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]quinazolin-4-yl]amine Formula: C16H14N6S2 MolecularWeight: 354.45256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CS4

Isomeric SMILES

CN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CS4

InChI

InChI=1S/C16H14N6S2/c1-22-15(12-7-4-8-23-12)20-21-16(22)24-9-13-18-11-6-3-2-5-10(11)14(17)19-13/h2-8H,9H2,1H3,(H2,17,18,19)