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

Systemtic Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]-4-quinazolinamine IUPAC Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]quinazolin-4-yl]amine Formula: C17H16N6S2 MolecularWeight: 368.47914

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CS4

Isomeric SMILES

CCN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CS4

InChI

InChI=1S/C17H16N6S2/c1-2-23-16(13-8-5-9-24-13)21-22-17(23)25-10-14-19-12-7-4-3-6-11(12)15(18)20-14/h3-9H,2,10H2,1H3,(H2,18,19,20)