2-[[5-indol-3-ylidene-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[5-indol-3-ylidene-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[5-indol-3-ylidene-4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[5-(3-indolylidene)-4-[[(2R)-2-oxolanyl]methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[5-indol-3-ylidene-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[5-indol-3-ylidene-4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C24H22N6O2S MolecularWeight: 458.53548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=C3C=NC4=CC=CC=C43)NN=C2SCC5=NC(=O)C6=CC=CC=C6N5

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=C3C=NC4=CC=CC=C43)NN=C2SCC5=NC(=O)C6=CC=CC=C6N5

InChI

InChI=1S/C24H22N6O2S/c31-23-17-8-2-4-10-20(17)26-21(27-23)14-33-24-29-28-22(30(24)13-15-6-5-11-32-15)18-12-25-19-9-3-1-7-16(18)19/h1-4,7-10,12,15,28H,5-6,11,13-14H2,(H,26,27,31)/t15-/m1/s1