3,5-dimethyl-4-[[4-(2-thiophen-3-ylquinazolin-4-yl)piperazin-1-yl]methyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[[4-(2-thiophen-3-ylquinazolin-4-yl)piperazin-1-yl]methyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[[4-[2-(3-thienyl)quinazolin-4-yl]piperazin-1-yl]methyl]isoxazole CAS Name: 3,5-dimethyl-4-[[4-[2-(3-thiophenyl)-4-quinazolinyl]-1-piperazinyl]methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[[4-(2-thiophen-3-ylquinazolin-4-yl)piperazin-1-yl]methyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[[4-[2-(3-thienyl)quinazolin-4-yl]piperazino]methyl]isoxazole Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CSC=C5

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CSC=C5

InChI

InChI=1S/C22H23N5OS/c1-15-19(16(2)28-25-15)13-26-8-10-27(11-9-26)22-18-5-3-4-6-20(18)23-21(24-22)17-7-12-29-14-17/h3-7,12,14H,8-11,13H2,1-2H3