6-bromanyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-propyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-propyl-quinazolin-4-one Openeye Name: 6-bromo-2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-3-propyl-quinazolin-4-one CAS Name: 6-bromo-2-[(3,3-dimethyl-2-oxobutyl)thio]-3-propyl-4-quinazolinone IUPAC Name: 6-bromo-2-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-propylquinazolin-4-one Traditional Name: 6-bromo-2-[(2-keto-3,3-dimethyl-butyl)thio]-3-propyl-quinazolin-4-one Formula: C17H21BrN2O2S MolecularWeight: 397.32984

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)C(C)(C)C

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)C(C)(C)C

InChI

InChI=1S/C17H21BrN2O2S/c1-5-8-20-15(22)12-9-11(18)6-7-13(12)19-16(20)23-10-14(21)17(2,3)4/h6-7,9H,5,8,10H2,1-4H3