4-methyl-N-[(2S)-3-methyl-1-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-methyl-N-[(2S)-3-methyl-1-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-methyl-N-[(1S)-2-methyl-1-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]carbamoyl]propyl]benzamide CAS Name: 4-methyl-N-[(2S)-3-methyl-1-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]amino]-1-oxobutan-2-yl]benzamide IUPAC Name: 4-methyl-N-[(2S)-3-methyl-1-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]amino]-1-oxobutan-2-yl]benzamide Traditional Name: 4-methyl-N-[(1S)-2-methyl-1-[[6-(4-methylpiperazino)-3-pyridyl]carbamoyl]propyl]benzamide Formula: C23H31N5O2 MolecularWeight: 409.52454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C23H31N5O2/c1-16(2)21(26-22(29)18-7-5-17(3)6-8-18)23(30)25-19-9-10-20(24-15-19)28-13-11-27(4)12-14-28/h5-10,15-16,21H,11-14H2,1-4H3,(H,25,30)(H,26,29)/t21-/m0/s1