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

Systemtic Name: 7-chloranyl-3-(3-methylbutyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 7-chloro-3-isopentyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-3-(3-methylbutyl)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-(3-methylbutyl)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 7-chloro-3-isoamyl-2-[(2-keto-2-piperidino-ethyl)thio]quinazolin-4-one Formula: C20H26ClN3O2S MolecularWeight: 407.95734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCCCC3

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCCCC3

InChI

InChI=1S/C20H26ClN3O2S/c1-14(2)8-11-24-19(26)16-7-6-15(21)12-17(16)22-20(24)27-13-18(25)23-9-4-3-5-10-23/h6-7,12,14H,3-5,8-11,13H2,1-2H3