2-[4-(methylamino)quinazolin-2-yl]sulfanyl-1-phenyl-propan-1-one

Systemtic Name: 2-[4-(methylamino)quinazolin-2-yl]sulfanyl-1-phenyl-propan-1-one Openeye Name: 2-[4-(methylamino)quinazolin-2-yl]sulfanyl-1-phenyl-propan-1-one CAS Name: 2-[[4-(methylamino)-2-quinazolinyl]thio]-1-phenyl-1-propanone IUPAC Name: 2-[4-(methylamino)quinazolin-2-yl]sulfanyl-1-phenylpropan-1-one Traditional Name: 2-[[4-(methylamino)quinazolin-2-yl]thio]-1-phenyl-propan-1-one Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3OS/c1-12(16(22)13-8-4-3-5-9-13)23-18-20-15-11-7-6-10-14(15)17(19-2)21-18/h3-12H,1-2H3,(H,19,20,21)