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

Systemtic Name: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-methoxypropyl)quinazolin-4-one Openeye Name: 2-[2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-3-(3-methoxypropyl)quinazolin-4-one CAS Name: 2-[[2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl]thio]-3-(3-methoxypropyl)-4-quinazolinone IUPAC Name: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-(3-methoxypropyl)quinazolin-4-one Traditional Name: 2-[[2-(2,6-dimethylpiperidino)-2-keto-ethyl]thio]-3-(3-methoxypropyl)quinazolin-4-one Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCOC)C

Isomeric SMILES

CC1CCCC(N1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCOC)C

InChI

InChI=1S/C21H29N3O3S/c1-15-8-6-9-16(2)24(15)19(25)14-28-21-22-18-11-5-4-10-17(18)20(26)23(21)12-7-13-27-3/h4-5,10-11,15-16H,6-9,12-14H2,1-3H3