2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(furan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(furan-2-ylmethyl)quinazolin-4-one Openeye Name: 2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-furylmethyl)quinazolin-4-one CAS Name: 2-[[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]methyl]-3-(2-furanylmethyl)-4-quinazolinone IUPAC Name: 2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(furan-2-ylmethyl)quinazolin-4-one Traditional Name: 2-[[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]methyl]-3-(2-furfuryl)quinazolin-4-one Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4)C5CC5

Isomeric SMILES

CN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4)C5CC5

InChI

InChI=1S/C20H19N5O2S/c1-24-18(13-8-9-13)22-23-20(24)28-12-17-21-16-7-3-2-6-15(16)19(26)25(17)11-14-5-4-10-27-14/h2-7,10,13H,8-9,11-12H2,1H3