2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-butan-2-yl-quinazolin-4-one

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-butan-2-yl-quinazolin-4-one Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-3-sec-butyl-quinazolin-4-one CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-3-butan-2-yl-4-quinazolinone IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-3-butan-2-ylquinazolin-4-one Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-3-sec-butyl-quinazolin-4-one Formula: C20H19BrN2O2S MolecularWeight: 431.34606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H19BrN2O2S/c1-3-13(2)23-19(25)16-6-4-5-7-17(16)22-20(23)26-12-18(24)14-8-10-15(21)11-9-14/h4-11,13H,3,12H2,1-2H3