N-[2-methyl-3-(1,2,3,4-tetrazol-1-yl)phenyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-[2-methyl-3-(1,2,3,4-tetrazol-1-yl)phenyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[2-methyl-3-(tetrazol-1-yl)phenyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[2-methyl-3-(1-tetrazolyl)phenyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-[2-methyl-3-(tetrazol-1-yl)phenyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: 4-(4-keto-1H-quinazolin-2-yl)-N-[2-methyl-3-(tetrazol-1-yl)phenyl]butyramide Formula: C20H19N7O2 MolecularWeight: 389.41056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2)N4C=NN=N4

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2)N4C=NN=N4

InChI

InChI=1S/C20H19N7O2/c1-13-15(8-4-9-17(13)27-12-21-25-26-27)23-19(28)11-5-10-18-22-16-7-3-2-6-14(16)20(29)24-18/h2-4,6-9,12H,5,10-11H2,1H3,(H,23,28)(H,22,24,29)