2-[3-[bis(azanyl)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-N-(3-methyl-4-piperidin-3-ylcarbonyl-phenyl)ethanamide

Systemtic Name: 2-[3-[bis(azanyl)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-N-(3-methyl-4-piperidin-3-ylcarbonyl-phenyl)ethanamide Openeye Name: 2-[3-(diaminomethylene)-6-oxo-cyclohexa-1,4-dien-1-yl]-N-[3-methyl-4-(piperidine-3-carbonyl)phenyl]acetamide CAS Name: 2-[3-(diaminomethylidene)-6-oxo-1-cyclohexa-1,4-dienyl]-N-[3-methyl-4-[oxo(3-piperidinyl)methyl]phenyl]acetamide IUPAC Name: 2-[3-(diaminomethylidene)-6-oxocyclohexa-1,4-dien-1-yl]-N-[3-methyl-4-(piperidine-3-carbonyl)phenyl]acetamide Traditional Name: 2-[3-(diaminomethylene)-6-keto-cyclohexa-1,4-dien-1-yl]-N-(3-methyl-4-nipecotoyl-phenyl)acetamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CC2=CC(=C(N)N)C=CC2=O)C(=O)C3CCCNC3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CC2=CC(=C(N)N)C=CC2=O)C(=O)C3CCCNC3

InChI

InChI=1S/C22H26N4O3/c1-13-9-17(5-6-18(13)21(29)15-3-2-8-25-12-15)26-20(28)11-16-10-14(22(23)24)4-7-19(16)27/h4-7,9-10,15,25H,2-3,8,11-12,23-24H2,1H3,(H,26,28)