3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[4-(cyclopropylcarbamoylamino)phenyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[4-(cyclopropylcarbamoylamino)phenyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[4-(cyclopropylcarbamoylamino)phenyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[4-[[(cyclopropylamino)-oxomethyl]amino]phenyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[4-(cyclopropylcarbamoylamino)phenyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[4-(cyclopropylcarbamoylamino)phenyl]propionamide Formula: C21H20BrN5O3 MolecularWeight: 470.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC2=CC=C(C=C2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CC1NC(=O)NC2=CC=C(C=C2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H20BrN5O3/c22-13-1-8-18-17(11-13)20(29)27(12-23-18)10-9-19(28)24-14-2-4-15(5-3-14)25-21(30)26-16-6-7-16/h1-5,8,11-12,16H,6-7,9-10H2,(H,24,28)(H2,25,26,30)