(2S)-2-acetamido-5-[2-chloroethylcarbamoyl(propyl)amino]-N-(phenylmethyl)pentanamide

Systemtic Name: (2S)-2-acetamido-5-[2-chloroethylcarbamoyl(propyl)amino]-N-(phenylmethyl)pentanamide Openeye Name: (2S)-2-acetamido-N-benzyl-5-[2-chloroethylcarbamoyl(propyl)amino]pentanamide CAS Name: (2S)-2-acetamido-5-[[(2-chloroethylamino)-oxomethyl]-propylamino]-N-(phenylmethyl)pentanamide IUPAC Name: (2S)-2-acetamido-N-benzyl-5-[2-chloroethylcarbamoyl(propyl)amino]pentanamide Traditional Name: (2S)-2-acetamido-N-benzyl-5-[2-chloroethylcarbamoyl(propyl)amino]valeramide Formula: C20H31ClN4O3 MolecularWeight: 410.93814

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(C(=O)NCC1=CC=CC=C1)NC(=O)C)C(=O)NCCCl

Isomeric SMILES

CCCN(CCC[C@@H](C(=O)NCC1=CC=CC=C1)NC(=O)C)C(=O)NCCCl

InChI

InChI=1S/C20H31ClN4O3/c1-3-13-25(20(28)22-12-11-21)14-7-10-18(24-16(2)26)19(27)23-15-17-8-5-4-6-9-17/h4-6,8-9,18H,3,7,10-15H2,1-2H3,(H,22,28)(H,23,27)(H,24,26)/t18-/m0/s1