2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)-3-[(2-methoxyphenyl)methyl]quinazolin-4-one

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)-3-[(2-methoxyphenyl)methyl]quinazolin-4-one Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-[(2-methoxyphenyl)methyl]quinazolin-4-one CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-7-[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(oxo)methyl]-3-[(2-methoxyphenyl)methyl]-4-quinazolinone IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-[(2-methoxyphenyl)methyl]quinazolin-4-one Traditional Name: 7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-[(2-keto-3,3-dimethyl-butyl)thio]-3-o-anisyl-quinazolin-4-one Formula: C30H35N3O6S MolecularWeight: 565.6804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCC4(CC3)OCCO4)C(=O)N1CC5=CC=CC=C5OC

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCC4(CC3)OCCO4)C(=O)N1CC5=CC=CC=C5OC

InChI

InChI=1S/C30H35N3O6S/c1-29(2,3)25(34)19-40-28-31-23-17-20(26(35)32-13-11-30(12-14-32)38-15-16-39-30)9-10-22(23)27(36)33(28)18-21-7-5-6-8-24(21)37-4/h5-10,17H,11-16,18-19H2,1-4H3