N-(3-piperidin-1-ylsulfonylphenyl)-2-quinazolin-4-ylsulfanyl-propanamide

Systemtic Name: N-(3-piperidin-1-ylsulfonylphenyl)-2-quinazolin-4-ylsulfanyl-propanamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-2-quinazolin-4-ylsulfanyl-propanamide CAS Name: N-[3-(1-piperidinylsulfonyl)phenyl]-2-(4-quinazolinylthio)propanamide IUPAC Name: N-(3-piperidin-1-ylsulfonylphenyl)-2-quinazolin-4-ylsulfanylpropanamide Traditional Name: N-(3-piperidinosulfonylphenyl)-2-(quinazolin-4-ylthio)propionamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)SC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)SC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C22H24N4O3S2/c1-16(30-22-19-10-3-4-11-20(19)23-15-24-22)21(27)25-17-8-7-9-18(14-17)31(28,29)26-12-5-2-6-13-26/h3-4,7-11,14-16H,2,5-6,12-13H2,1H3,(H,25,27)