3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(3,4-dihydro-2H-thiochromen-4-yl)propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(3,4-dihydro-2H-thiochromen-4-yl)propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-thiochroman-4-yl-propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-(3,4-dihydro-2H-thiochromen-4-yl)propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-thiochroman-4-yl-propionamide Formula: C20H18BrN3O2S MolecularWeight: 444.34482

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C20H18BrN3O2S/c21-13-5-6-16-15(11-13)20(26)24(12-22-16)9-7-19(25)23-17-8-10-27-18-4-2-1-3-14(17)18/h1-6,11-12,17H,7-10H2,(H,23,25)