2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]ethanamide

Systemtic Name: 2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]ethanamide Openeye Name: 2-[6-bromo-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]acetamide CAS Name: 2-[[6-bromo-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-[2-(1-cyclohexenyl)ethyl]acetamide IUPAC Name: 2-[6-bromo-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]acetamide Traditional Name: 2-[[6-bromo-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-[2-(cyclohexen-1-yl)ethyl]acetamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCCC3=CCCCC3

Isomeric SMILES

COCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCCC3=CCCCC3

InChI

InChI=1S/C21H26BrN3O3S/c1-28-12-11-25-20(27)17-13-16(22)7-8-18(17)24-21(25)29-14-19(26)23-10-9-15-5-3-2-4-6-15/h5,7-8,13H,2-4,6,9-12,14H2,1H3,(H,23,26)