1-[4-(phenylmethyl)piperidin-1-yl]-2-quinazolin-4-ylsulfanyl-propan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-2-quinazolin-4-ylsulfanyl-propan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-2-quinazolin-4-ylsulfanyl-propan-1-one CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-2-(4-quinazolinylthio)-1-propanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-quinazolin-4-ylsulfanylpropan-1-one Traditional Name: 1-(4-benzylpiperidino)-2-(quinazolin-4-ylthio)propan-1-one Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)SC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)SC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C23H25N3OS/c1-17(28-22-20-9-5-6-10-21(20)24-16-25-22)23(27)26-13-11-19(12-14-26)15-18-7-3-2-4-8-18/h2-10,16-17,19H,11-15H2,1H3