4-(2-methoxy-5-methyl-phenyl)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(2-methoxy-5-methyl-phenyl)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-4-oxidanylidene-butanamide Openeye Name: 4-(2-methoxy-5-methyl-phenyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]-4-oxo-butanamide CAS Name: 4-(2-methoxy-5-methylphenyl)-N-[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-4-oxobutanamide IUPAC Name: 4-(2-methoxy-5-methylphenyl)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-4-oxobutanamide Traditional Name: 4-keto-4-(2-methoxy-5-methyl-phenyl)-N-[6-(4-methylpiperazino)-3-pyridyl]butyramide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C22H28N4O3/c1-16-4-7-20(29-3)18(14-16)19(27)6-9-22(28)24-17-5-8-21(23-15-17)26-12-10-25(2)11-13-26/h4-5,7-8,14-15H,6,9-13H2,1-3H3,(H,24,28)