1-(3-methylpiperidin-1-yl)-2-quinazolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-(3-methylpiperidin-1-yl)-2-quinazolin-4-ylsulfanyl-ethanone Openeye Name: 1-(3-methyl-1-piperidyl)-2-quinazolin-4-ylsulfanyl-ethanone CAS Name: 1-(3-methyl-1-piperidinyl)-2-(4-quinazolinylthio)ethanone IUPAC Name: 1-(3-methylpiperidin-1-yl)-2-quinazolin-4-ylsulfanylethanone Traditional Name: 1-(3-methylpiperidino)-2-(quinazolin-4-ylthio)ethanone Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC1CCCN(C1)C(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C16H19N3OS/c1-12-5-4-8-19(9-12)15(20)10-21-16-13-6-2-3-7-14(13)17-11-18-16/h2-3,6-7,11-12H,4-5,8-10H2,1H3