7-chloranyl-2-[1-(2-ethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[1-(2-ethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Openeye Name: 7-chloro-2-[2-(2-ethyl-1-piperidyl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one CAS Name: 7-chloro-2-[[1-(2-ethyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-3-(2-methoxyethyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[1-(2-ethylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Traditional Name: 7-chloro-2-[[2-(2-ethylpiperidino)-2-keto-1-methyl-ethyl]thio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C21H28ClN3O3S MolecularWeight: 437.98332

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCOC

Isomeric SMILES

CCC1CCCCN1C(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCOC

InChI

InChI=1S/C21H28ClN3O3S/c1-4-16-7-5-6-10-24(16)19(26)14(2)29-21-23-18-13-15(22)8-9-17(18)20(27)25(21)11-12-28-3/h8-9,13-14,16H,4-7,10-12H2,1-3H3