N-[4-(tert-butylcarbamoyl)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-[(tert-butylamino)-oxomethyl]phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-(tert-butylcarbamoyl)phenyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C21H22N4O3/c1-21(2,3)23-18(26)13-9-11-14(12-10-13)22-19(27)17-15-7-5-6-8-16(15)20(28)25(4)24-17/h5-12H,1-4H3,(H,22,27)(H,23,26)