4-(4-oxidanylidenequinazolin-3-yl)-N-[4-(prop-2-enylcarbamoylamino)phenyl]butanamide

Systemtic Name: 4-(4-oxidanylidenequinazolin-3-yl)-N-[4-(prop-2-enylcarbamoylamino)phenyl]butanamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: 4-(4-oxoquinazolin-3-yl)-N-[4-(prop-2-enylcarbamoylamino)phenyl]butanamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H23N5O3/c1-2-13-23-22(30)26-17-11-9-16(10-12-17)25-20(28)8-5-14-27-15-24-19-7-4-3-6-18(19)21(27)29/h2-4,6-7,9-12,15H,1,5,8,13-14H2,(H,25,28)(H2,23,26,30)