3-phenyl-2-(2-piperidin-1-ylethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-phenyl-2-(2-piperidin-1-ylethylsulfanyl)quinazolin-4-one Openeye Name: 3-phenyl-2-[2-(1-piperidyl)ethylsulfanyl]quinazolin-4-one CAS Name: 3-phenyl-2-[2-(1-piperidinyl)ethylthio]-4-quinazolinone IUPAC Name: 3-phenyl-2-(2-piperidin-1-ylethylsulfanyl)quinazolin-4-one Traditional Name: 3-phenyl-2-(2-piperidinoethylthio)quinazolin-4-one Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C21H23N3OS/c25-20-18-11-5-6-12-19(18)22-21(24(20)17-9-3-1-4-10-17)26-16-15-23-13-7-2-8-14-23/h1,3-6,9-12H,2,7-8,13-16H2