N1-[5-benzamido-6-cyano-3,4-bis(oxidanyl)-1-phenyl-hexan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[5-benzamido-6-cyano-3,4-bis(oxidanyl)-1-phenyl-hexan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-(4-benzamido-1-benzyl-5-cyano-2,3-dihydroxy-pentyl)-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-(5-benzamido-6-cyano-3,4-dihydroxy-1-phenylhexan-2-yl)-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-(5-benzamido-6-cyano-3,4-dihydroxy-1-phenylhexan-2-yl)-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-(4-benzamido-1-benzyl-5-cyano-2,3-dihydroxy-pentyl)-5-methyl-N',N'-dipropyl-isophthalamide Formula: C35H42N4O5 MolecularWeight: 598.73178

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(C(C(CC#N)NC(=O)C3=CC=CC=C3)O)O)C

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(C(C(CC#N)NC(=O)C3=CC=CC=C3)O)O)C

InChI

InChI=1S/C35H42N4O5/c1-4-18-39(19-5-2)35(44)28-21-24(3)20-27(23-28)34(43)38-30(22-25-12-8-6-9-13-25)32(41)31(40)29(16-17-36)37-33(42)26-14-10-7-11-15-26/h6-15,20-21,23,29-32,40-41H,4-5,16,18-19,22H2,1-3H3,(H,37,42)(H,38,43)