6-chloranyl-3-(2-methylpropyl)-2-(4-oxidanylidene-4-thiophen-2-yl-butyl)sulfanyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-3-(2-methylpropyl)-2-(4-oxidanylidene-4-thiophen-2-yl-butyl)sulfanyl-quinazolin-4-one Openeye Name: 6-chloro-3-isobutyl-2-[4-oxo-4-(2-thienyl)butyl]sulfanyl-quinazolin-4-one CAS Name: 6-chloro-3-(2-methylpropyl)-2-[(4-oxo-4-thiophen-2-ylbutyl)thio]-4-quinazolinone IUPAC Name: 6-chloro-3-(2-methylpropyl)-2-(4-oxo-4-thiophen-2-ylbutyl)sulfanylquinazolin-4-one Traditional Name: 6-chloro-3-isobutyl-2-[[4-keto-4-(2-thienyl)butyl]thio]quinazolin-4-one Formula: C20H21ClN2O2S2 MolecularWeight: 420.97594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCCCC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C20H21ClN2O2S2/c1-13(2)12-23-19(25)15-11-14(21)7-8-16(15)22-20(23)27-10-3-5-17(24)18-6-4-9-26-18/h4,6-9,11,13H,3,5,10,12H2,1-2H3