4-methyl-2-[[4-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-(phenylmethyl)butanoyl]amino]pentanamide

Systemtic Name: 4-methyl-2-[[4-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-(phenylmethyl)butanoyl]amino]pentanamide Openeye Name: 2-[[2-benzyl-4-(4-methylpiperazin-1-yl)-4-oxo-butanoyl]amino]-4-methyl-pentanamide CAS Name: 4-methyl-2-[[4-(4-methyl-1-piperazinyl)-1,4-dioxo-2-(phenylmethyl)butyl]amino]pentanamide IUPAC Name: 2-[[2-benzyl-4-(4-methylpiperazin-1-yl)-4-oxobutanoyl]amino]-4-methylpentanamide Traditional Name: 2-[[2-benzyl-4-keto-4-(4-methylpiperazino)butanoyl]amino]-4-methyl-valeramide Formula: C22H34N4O3 MolecularWeight: 402.53036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)C(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)C

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)C(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)C

InChI

InChI=1S/C22H34N4O3/c1-16(2)13-19(21(23)28)24-22(29)18(14-17-7-5-4-6-8-17)15-20(27)26-11-9-25(3)10-12-26/h4-8,16,18-19H,9-15H2,1-3H3,(H2,23,28)(H,24,29)