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

Systemtic Name: 2-[3-[bis(azanyl)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-2-methyl-N-(3-methyl-4-pyrrolidin-1-ylcarbonyl-phenyl)propanamide Openeye Name: 2-[3-(diaminomethylene)-6-oxo-cyclohexa-1,4-dien-1-yl]-2-methyl-N-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide CAS Name: 2-[3-(diaminomethylidene)-6-oxo-1-cyclohexa-1,4-dienyl]-2-methyl-N-[3-methyl-4-[oxo(1-pyrrolidinyl)methyl]phenyl]propanamide IUPAC Name: 2-[3-(diaminomethylidene)-6-oxocyclohexa-1,4-dien-1-yl]-2-methyl-N-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide Traditional Name: 2-[3-(diaminomethylene)-6-keto-cyclohexa-1,4-dien-1-yl]-2-methyl-N-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propionamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(C)(C)C2=CC(=C(N)N)C=CC2=O)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C(C)(C)C2=CC(=C(N)N)C=CC2=O)C(=O)N3CCCC3

InChI

InChI=1S/C23H28N4O3/c1-14-12-16(7-8-17(14)21(29)27-10-4-5-11-27)26-22(30)23(2,3)18-13-15(20(24)25)6-9-19(18)28/h6-9,12-13H,4-5,10-11,24-25H2,1-3H3,(H,26,30)