2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)propanamide

Systemtic Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)propanamide Openeye Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)propanamide CAS Name: 2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-N-(3,5-dimethoxyphenyl)propanamide IUPAC Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)propanamide Traditional Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]-N-(3,5-dimethoxyphenyl)propionamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC(=C1)OC)OC)SC2=NC3=CC=CC=C3C(=N2)NC4CC4

Isomeric SMILES

CC(C(=O)NC1=CC(=CC(=C1)OC)OC)SC2=NC3=CC=CC=C3C(=N2)NC4CC4

InChI

InChI=1S/C22H24N4O3S/c1-13(21(27)24-15-10-16(28-2)12-17(11-15)29-3)30-22-25-19-7-5-4-6-18(19)20(26-22)23-14-8-9-14/h4-7,10-14H,8-9H2,1-3H3,(H,24,27)(H,23,25,26)