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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SCC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CO5

Isomeric SMILES

CC1=NN=C(N1C2CC2)SCC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CO5

InChI

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