(2R)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: (2R)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2R)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2R)-2-[(2-cyclopropyl-4-quinazolinyl)thio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2R)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2R)-2-[(2-cyclopropylquinazolin-4-yl)thio]-1-(4-phenylpiperazino)propan-1-one Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=NC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=NC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C24H26N4OS/c1-17(24(29)28-15-13-27(14-16-28)19-7-3-2-4-8-19)30-23-20-9-5-6-10-21(20)25-22(26-23)18-11-12-18/h2-10,17-18H,11-16H2,1H3/t17-/m1/s1