N-(3,4-dimethoxyphenyl)-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[[4-(methylamino)-2-quinazolinyl]thio]propanamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[4-(methylamino)quinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[[4-(methylamino)quinazolin-2-yl]thio]propionamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SC2=NC3=CC=CC=C3C(=N2)NC

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SC2=NC3=CC=CC=C3C(=N2)NC

InChI

InChI=1S/C20H22N4O3S/c1-12(19(25)22-13-9-10-16(26-3)17(11-13)27-4)28-20-23-15-8-6-5-7-14(15)18(21-2)24-20/h5-12H,1-4H3,(H,22,25)(H,21,23,24)