6-chloranyl-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-chloro-2-[(1R)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 6-chloro-2-[[(2R)-1-oxo-1-(1-piperidinyl)propan-2-yl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-chloro-2-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-chloro-2-[[(1R)-2-keto-1-methyl-2-piperidino-ethyl]thio]quinazolin-4-one Formula: C19H22ClN3O2S MolecularWeight: 391.91488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)SC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

Isomeric SMILES

C[C@H](C(=O)N1CCCCC1)SC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

InChI

InChI=1S/C19H22ClN3O2S/c1-3-9-23-18(25)15-12-14(20)7-8-16(15)21-19(23)26-13(2)17(24)22-10-5-4-6-11-22/h3,7-8,12-13H,1,4-6,9-11H2,2H3/t13-/m1/s1