4-phenyl-3-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-1,4-dihydroquinazolin-2-one hydrochloride

Systemtic Name: 4-phenyl-3-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-1,4-dihydroquinazolin-2-one hydrochloride Openeye Name: 4-phenyl-3-[1-(2-thienylmethyl)-4-piperidyl]-1,4-dihydroquinazolin-2-one hydrochloride CAS Name: 4-phenyl-3-[1-(thiophen-2-ylmethyl)-4-piperidinyl]-1,4-dihydroquinazolin-2-one hydrochloride IUPAC Name: 4-phenyl-3-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-1,4-dihydroquinazolin-2-one hydrochloride Traditional Name: 4-phenyl-3-[1-(2-thenyl)-4-piperidyl]-1,4-dihydroquinazolin-2-one hydrochloride Formula: C24H26ClN3OS MolecularWeight: 440.00074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4)CC5=CC=CS5.Cl

Isomeric SMILES

C1CN(CCC1N2C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4)CC5=CC=CS5.Cl

InChI

InChI=1S/C24H25N3OS.ClH/c28-24-25-22-11-5-4-10-21(22)23(18-7-2-1-3-8-18)27(24)19-12-14-26(15-13-19)17-20-9-6-16-29-20;/h1-11,16,19,23H,12-15,17H2,(H,25,28);1H