2-[3-[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-N-phenyl-propanamide

Systemtic Name: 2-[3-[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-N-phenyl-propanamide Openeye Name: 2-[3-[(3,4-dimethoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-N-phenyl-propanamide CAS Name: 2-[[3-[(3,4-dimethoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-methyl-N-phenylpropanamide IUPAC Name: 2-[3-[(3,4-dimethoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-methyl-N-phenylpropanamide Traditional Name: 2-[(4-keto-3-veratryl-quinazolin-2-yl)thio]-N-methyl-N-phenyl-propionamide Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C(=O)N(C)C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H27N3O4S/c1-18(25(31)29(2)20-10-6-5-7-11-20)35-27-28-22-13-9-8-12-21(22)26(32)30(27)17-19-14-15-23(33-3)24(16-19)34-4/h5-16,18H,17H2,1-4H3