2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-[(2-methoxyphenyl)methyl]propanamide

Systemtic Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-[(2-methoxyphenyl)methyl]propanamide Openeye Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-[(2-methoxyphenyl)methyl]propanamide CAS Name: 2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-N-[(2-methoxyphenyl)methyl]propanamide IUPAC Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-[(2-methoxyphenyl)methyl]propanamide Traditional Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]-N-o-anisyl-propionamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1OC)SC2=NC3=CC=CC=C3C(=N2)NC4CC4

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1OC)SC2=NC3=CC=CC=C3C(=N2)NC4CC4

InChI

InChI=1S/C22H24N4O2S/c1-14(21(27)23-13-15-7-3-6-10-19(15)28-2)29-22-25-18-9-5-4-8-17(18)20(26-22)24-16-11-12-16/h3-10,14,16H,11-13H2,1-2H3,(H,23,27)(H,24,25,26)