2-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(3-methoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(3-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[2-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-3-(3-methoxyphenyl)quinazolin-4-one CAS Name: 2-[[2-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-oxoethyl]thio]-3-(3-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]sulfanyl-3-(3-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[[2-[(2R,6R)-2,6-dimethylpiperidino]-2-keto-ethyl]thio]-3-(3-methoxyphenyl)quinazolin-4-one Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC)C

InChI

InChI=1S/C24H27N3O3S/c1-16-8-6-9-17(2)26(16)22(28)15-31-24-25-21-13-5-4-12-20(21)23(29)27(24)18-10-7-11-19(14-18)30-3/h4-5,7,10-14,16-17H,6,8-9,15H2,1-3H3/t16-,17-/m1/s1