N-methyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-[(4-prop-2-enoxyphenyl)methyl]hexanamide

Systemtic Name: N-methyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-[(4-prop-2-enoxyphenyl)methyl]hexanamide Openeye Name: N-[(4-allyloxyphenyl)methyl]-N-methyl-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-methyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[(4-prop-2-enoxyphenyl)methyl]hexanamide IUPAC Name: N-methyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[(4-prop-2-enoxyphenyl)methyl]hexanamide Traditional Name: N-(4-allyloxybenzyl)-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-methyl-hexanamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OCC=C)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CN(CC1=CC=C(C=C1)OCC=C)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C25H29N3O3S/c1-3-17-31-20-14-12-19(13-15-20)18-27(2)23(29)11-5-4-8-16-28-24(30)21-9-6-7-10-22(21)26-25(28)32/h3,6-7,9-10,12-15H,1,4-5,8,11,16-18H2,2H3,(H,26,32)