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

Systemtic Name: 2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]-4-quinazolinamine IUPAC Name: 2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]quinazolin-4-yl]amine Formula: C15H16N6S MolecularWeight: 312.39274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC2=NC3=CC=CC=C3C(=N2)N

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC2=NC3=CC=CC=C3C(=N2)N

InChI

InChI=1S/C15H16N6S/c1-3-8-21-10(2)19-20-15(21)22-9-13-17-12-7-5-4-6-11(12)14(16)18-13/h3-7H,1,8-9H2,2H3,(H2,16,17,18)