3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[cyclopentyl(thiophen-2-yl)methyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[cyclopentyl(thiophen-2-yl)methyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[cyclopentyl(2-thienyl)methyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[cyclopentyl(thiophen-2-yl)methyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[cyclopentyl(thiophen-2-yl)methyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[cyclopentyl(2-thienyl)methyl]propionamide Formula: C21H22BrN3O2S MolecularWeight: 460.38728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CS2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CCC(C1)C(C2=CC=CS2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H22BrN3O2S/c22-15-7-8-17-16(12-15)21(27)25(13-23-17)10-9-19(26)24-20(14-4-1-2-5-14)18-6-3-11-28-18/h3,6-8,11-14,20H,1-2,4-5,9-10H2,(H,24,26)