1-(3,5-dimethylpiperidin-1-yl)-2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanone

Systemtic Name: 1-(3,5-dimethylpiperidin-1-yl)-2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanone Openeye Name: 1-(3,5-dimethyl-1-piperidyl)-2-[4-[2-(2-thienyl)quinazolin-4-yl]piperazin-1-yl]ethanone CAS Name: 1-(3,5-dimethyl-1-piperidinyl)-2-[4-(2-thiophen-2-yl-4-quinazolinyl)-1-piperazinyl]ethanone IUPAC Name: 1-(3,5-dimethylpiperidin-1-yl)-2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanone Traditional Name: 1-(3,5-dimethylpiperidino)-2-[4-[2-(2-thienyl)quinazolin-4-yl]piperazino]ethanone Formula: C25H31N5OS MolecularWeight: 449.61154

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CS5)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CS5)C

InChI

InChI=1S/C25H31N5OS/c1-18-14-19(2)16-30(15-18)23(31)17-28-9-11-29(12-10-28)25-20-6-3-4-7-21(20)26-24(27-25)22-8-5-13-32-22/h3-8,13,18-19H,9-12,14-17H2,1-2H3