(2S)-2-acetamido-6-[[methyl(nitroso)carbamoyl]-propyl-amino]-N-(phenylmethyl)hexanamide

Systemtic Name: (2S)-2-acetamido-6-[[methyl(nitroso)carbamoyl]-propyl-amino]-N-(phenylmethyl)hexanamide Openeye Name: (2S)-2-acetamido-N-benzyl-6-[[methyl(nitroso)carbamoyl]-propyl-amino]hexanamide CAS Name: (2S)-2-acetamido-6-[[[methyl(nitroso)amino]-oxomethyl]-propylamino]-N-(phenylmethyl)hexanamide IUPAC Name: (2S)-2-acetamido-N-benzyl-6-[[methyl(nitroso)carbamoyl]-propylamino]hexanamide Traditional Name: (2S)-2-acetamido-N-benzyl-6-[[methyl(nitroso)carbamoyl]-propyl-amino]hexanamide Formula: C20H31N5O4 MolecularWeight: 405.49124

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCC(C(=O)NCC1=CC=CC=C1)NC(=O)C)C(=O)N(C)N=O

Isomeric SMILES

CCCN(CCCC[C@@H](C(=O)NCC1=CC=CC=C1)NC(=O)C)C(=O)N(C)N=O

InChI

InChI=1S/C20H31N5O4/c1-4-13-25(20(28)24(3)23-29)14-9-8-12-18(22-16(2)26)19(27)21-15-17-10-6-5-7-11-17/h5-7,10-11,18H,4,8-9,12-15H2,1-3H3,(H,21,27)(H,22,26)/t18-/m0/s1