2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-6,7-dimethoxy-quinazolin-4-one

Systemtic Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-6,7-dimethoxy-quinazolin-4-one Openeye Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-6,7-dimethoxy-quinazolin-4-one CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-3-[2-(3,4-dimethoxyphenyl)ethyl]-6,7-dimethoxy-4-quinazolinone IUPAC Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-6,7-dimethoxyquinazolin-4-one Traditional Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-3-homoveratryl-6,7-dimethoxy-quinazolin-4-one Formula: C31H33N3O6S MolecularWeight: 575.67522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=O)C3=CC(=C(C=C3N=C2SCC(=O)N4CCCC5=CC=CC=C54)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=O)C3=CC(=C(C=C3N=C2SCC(=O)N4CCCC5=CC=CC=C54)OC)OC)OC

InChI

InChI=1S/C31H33N3O6S/c1-37-25-12-11-20(16-26(25)38-2)13-15-34-30(36)22-17-27(39-3)28(40-4)18-23(22)32-31(34)41-19-29(35)33-14-7-9-21-8-5-6-10-24(21)33/h5-6,8,10-12,16-18H,7,9,13-15,19H2,1-4H3