4-(6-bromanyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-methoxyethyl)butanamide

Systemtic Name: 4-(6-bromanyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-methoxyethyl)butanamide Openeye Name: 4-(6-bromo-4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-(2-methoxyethyl)butanamide CAS Name: 4-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-methoxyethyl)butanamide IUPAC Name: 4-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-methoxyethyl)butanamide Traditional Name: 4-(6-bromo-4-keto-2-thioxo-1H-quinazolin-3-yl)-N-(2-methoxyethyl)butyramide Formula: C15H18BrN3O3S MolecularWeight: 400.29072

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CCCN1C(=O)C2=C(C=CC(=C2)Br)NC1=S

Isomeric SMILES

COCCNC(=O)CCCN1C(=O)C2=C(C=CC(=C2)Br)NC1=S

InChI

InChI=1S/C15H18BrN3O3S/c1-22-8-6-17-13(20)3-2-7-19-14(21)11-9-10(16)4-5-12(11)18-15(19)23/h4-5,9H,2-3,6-8H2,1H3,(H,17,20)(H,18,23)