1-[methyl-[3-[(4-methylpiperazin-1-yl)carbonylamino]-2-oxidanylidene-4-phenyl-butyl]carbamoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[methyl-[3-[(4-methylpiperazin-1-yl)carbonylamino]-2-oxidanylidene-4-phenyl-butyl]carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[methyl-[3-[(4-methylpiperazine-1-carbonyl)amino]-2-oxo-4-phenyl-butyl]carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[methyl-[3-[[(4-methyl-1-piperazinyl)-oxomethyl]amino]-2-oxo-4-phenylbutyl]amino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[methyl-[3-[(4-methylpiperazine-1-carbonyl)amino]-2-oxo-4-phenylbutyl]carbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[2-keto-3-[(4-methylpiperazine-1-carbonyl)amino]-4-phenyl-butyl]-methyl-carbamoyl]proline Formula: C23H33N5O5 MolecularWeight: 459.53862

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)CN(C)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)CN(C)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C23H33N5O5/c1-25-11-13-27(14-12-25)22(32)24-18(15-17-7-4-3-5-8-17)20(29)16-26(2)23(33)28-10-6-9-19(28)21(30)31/h3-5,7-8,18-19H,6,9-16H2,1-2H3,(H,24,32)(H,30,31)