7-chloranyl-3-cyclohexyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-3-cyclohexyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 7-chloro-3-cyclohexyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-3-cyclohexyl-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-cyclohexyl-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 7-chloro-3-cyclohexyl-2-[(2-keto-2-piperidino-ethyl)thio]quinazolin-4-one Formula: C21H26ClN3O2S MolecularWeight: 419.96804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)N4CCCCC4

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)N4CCCCC4

InChI

InChI=1S/C21H26ClN3O2S/c22-15-9-10-17-18(13-15)23-21(25(20(17)27)16-7-3-1-4-8-16)28-14-19(26)24-11-5-2-6-12-24/h9-10,13,16H,1-8,11-12,14H2