2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 2-[[4-(ethylamino)-2-quinazolinyl]thio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 2-[[4-(ethylamino)quinazolin-2-yl]thio]-1-(4-phenylpiperazino)propan-1-one Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SC(C)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SC(C)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H27N5OS/c1-3-24-21-19-11-7-8-12-20(19)25-23(26-21)30-17(2)22(29)28-15-13-27(14-16-28)18-9-5-4-6-10-18/h4-12,17H,3,13-16H2,1-2H3,(H,24,25,26)