N1,N3-bis[(2S)-4-methyl-1-(2-methylpropylamino)-1-oxidanylidene-pentan-2-yl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[(2S)-4-methyl-1-(2-methylpropylamino)-1-oxidanylidene-pentan-2-yl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[(1S)-1-(isobutylcarbamoyl)-3-methyl-butyl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[(2S)-4-methyl-1-(2-methylpropylamino)-1-oxopentan-2-yl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[(2S)-4-methyl-1-(2-methylpropylamino)-1-oxopentan-2-yl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[(1S)-1-(isobutylcarbamoyl)-3-methyl-butyl]isophthalamide Formula: C28H46N4O4 MolecularWeight: 502.68924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC(C)C)NC(=O)C1=CC(=CC=C1)C(=O)NC(CC(C)C)C(=O)NCC(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC(C)C)NC(=O)C1=CC(=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(C)C

InChI

InChI=1S/C28H46N4O4/c1-17(2)12-23(27(35)29-15-19(5)6)31-25(33)21-10-9-11-22(14-21)26(34)32-24(13-18(3)4)28(36)30-16-20(7)8/h9-11,14,17-20,23-24H,12-13,15-16H2,1-8H3,(H,29,35)(H,30,36)(H,31,33)(H,32,34)/t23-,24-/m0/s1