N-[(2S)-2-azanyl-3-heptan-4-ylsulfonyl-propanoyl]-2-methyl-propanamide

Systemtic Name: N-[(2S)-2-azanyl-3-heptan-4-ylsulfonyl-propanoyl]-2-methyl-propanamide Openeye Name: N-[(2S)-2-amino-3-(1-propylbutylsulfonyl)propanoyl]-2-methyl-propanamide CAS Name: N-[(2S)-2-amino-3-heptan-4-ylsulfonyl-1-oxopropyl]-2-methylpropanamide IUPAC Name: N-[(2S)-2-amino-3-heptan-4-ylsulfonylpropanoyl]-2-methylpropanamide Traditional Name: N-[(2S)-2-amino-3-(1-propylbutylsulfonyl)propanoyl]-2-methyl-propionamide Formula: C14H28N2O4S MolecularWeight: 320.44812

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(=O)C(C)C)N

Isomeric SMILES

CCCC(CCC)S(=O)(=O)C[C@H](C(=O)NC(=O)C(C)C)N

InChI

InChI=1S/C14H28N2O4S/c1-5-7-11(8-6-2)21(19,20)9-12(15)14(18)16-13(17)10(3)4/h10-12H,5-9,15H2,1-4H3,(H,16,17,18)/t12-/m1/s1