N-[4-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[4-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[4-(1-cyclopropyl-5-tetrazolyl)phenyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C22H21N7O2 MolecularWeight: 415.44784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)C3=CC=C(C=C3)NC(=O)CCCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1CC1N2C(=NN=N2)C3=CC=C(C=C3)NC(=O)CCCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C22H21N7O2/c30-20(6-3-13-28-14-23-19-5-2-1-4-18(19)22(28)31)24-16-9-7-15(8-10-16)21-25-26-27-29(21)17-11-12-17/h1-2,4-5,7-10,14,17H,3,6,11-13H2,(H,24,30)