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

Systemtic Name: 2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[4-allyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[[5-(2-furanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]methyl]-4-quinazolinamine IUPAC Name: 2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[4-allyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]methyl]quinazolin-4-yl]amine Formula: C18H16N6OS MolecularWeight: 364.42424

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CO4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CO4

InChI

InChI=1S/C18H16N6OS/c1-2-9-24-17(14-8-5-10-25-14)22-23-18(24)26-11-15-20-13-7-4-3-6-12(13)16(19)21-15/h2-8,10H,1,9,11H2,(H2,19,20,21)