1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-propan-1-one

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-propan-1-one Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-propan-1-one CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[4-(methylamino)-2-quinazolinyl]thio]-1-propanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(methylamino)quinazolin-2-yl]sulfanylpropan-1-one Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[4-(methylamino)quinazolin-2-yl]thio]propan-1-one Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC4=CC=CC=C4C(=N3)NC

Isomeric SMILES

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC4=CC=CC=C4C(=N3)NC

InChI

InChI=1S/C21H22N4OS/c1-14(20(26)25-13-7-9-15-8-3-6-12-18(15)25)27-21-23-17-11-5-4-10-16(17)19(22-2)24-21/h3-6,8,10-12,14H,7,9,13H2,1-2H3,(H,22,23,24)