4,6-dimethyl-5-[3-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-5-[3-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-5-[3-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]-3-oxo-propyl]-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-5-[3-[4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]-3-oxopropyl]-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 4,6-dimethyl-5-[3-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-3-oxopropyl]-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 2-keto-5-[3-keto-3-[4-[(3-methylisoxazol-5-yl)methyl]piperazino]propyl]-4,6-dimethyl-1H-pyridine-3-carbonitrile Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CN2CCN(CC2)C(=O)CCC3=C(NC(=O)C(=C3C)C#N)C

Isomeric SMILES

CC1=NOC(=C1)CN2CCN(CC2)C(=O)CCC3=C(NC(=O)C(=C3C)C#N)C

InChI

InChI=1S/C20H25N5O3/c1-13-10-16(28-23-13)12-24-6-8-25(9-7-24)19(26)5-4-17-14(2)18(11-21)20(27)22-15(17)3/h10H,4-9,12H2,1-3H3,(H,22,27)