1-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-3-(3-methylphenoxy)propan-2-ol

Systemtic Name: 1-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-3-(3-methylphenoxy)propan-2-ol Openeye Name: 1-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-3-(3-methylphenoxy)propan-2-ol CAS Name: 1-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-3-(3-methylphenoxy)-2-propanol IUPAC Name: 1-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-3-(3-methylphenoxy)propan-2-ol Traditional Name: 1-[[4-(cyclopropylamino)quinazolin-2-yl]thio]-3-(3-methylphenoxy)propan-2-ol Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CSC2=NC3=CC=CC=C3C(=N2)NC4CC4)O

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CSC2=NC3=CC=CC=C3C(=N2)NC4CC4)O

InChI

InChI=1S/C21H23N3O2S/c1-14-5-4-6-17(11-14)26-12-16(25)13-27-21-23-19-8-3-2-7-18(19)20(24-21)22-15-9-10-15/h2-8,11,15-16,25H,9-10,12-13H2,1H3,(H,22,23,24)