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

Systemtic Name: 2-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[2-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one CAS Name: 2-[[2-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-oxoethyl]thio]-3-(2-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]sulfanyl-3-(2-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[[2-[(2R,6R)-2,6-dimethylpiperidino]-2-keto-ethyl]thio]-3-(2-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=C4OC)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OC)C

InChI

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