3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(2-ethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[[2-(2-ethyl-1-piperidinyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[[2-(2-ethylpiperidino)-2-keto-ethyl]thio]quinazolin-4-one Formula: C26H29N3O4S MolecularWeight: 479.59116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4COC5=CC=CC=C5O4

Isomeric SMILES

CCC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4COC5=CC=CC=C5O4

InChI

InChI=1S/C26H29N3O4S/c1-2-18-9-7-8-14-28(18)24(30)17-34-26-27-21-11-4-3-10-20(21)25(31)29(26)15-19-16-32-22-12-5-6-13-23(22)33-19/h3-6,10-13,18-19H,2,7-9,14-17H2,1H3