N-(3,4-dimethylphenyl)-6-oxidanylidene-1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]pyridazine-3-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-6-oxidanylidene-1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]pyridazine-3-carboxamide Openeye Name: 1-[2-(benzylamino)-2-oxo-ethyl]-N-(3,4-dimethylphenyl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-(3,4-dimethylphenyl)-6-oxo-1-[2-oxo-2-[(phenylmethyl)amino]ethyl]-3-pyridazinecarboxamide IUPAC Name: 1-[2-(benzylamino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-[2-(benzylamino)-2-keto-ethyl]-N-(3,4-dimethylphenyl)-6-keto-pyridazine-3-carboxamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C22H22N4O3/c1-15-8-9-18(12-16(15)2)24-22(29)19-10-11-21(28)26(25-19)14-20(27)23-13-17-6-4-3-5-7-17/h3-12H,13-14H2,1-2H3,(H,23,27)(H,24,29)