(2S)-2-azanyl-N-[(E,3S)-5-methyl-1-methylsulfonyl-hex-1-en-3-yl]-3-oxidanyl-propanamide

Systemtic Name: (2S)-2-azanyl-N-[(E,3S)-5-methyl-1-methylsulfonyl-hex-1-en-3-yl]-3-oxidanyl-propanamide Openeye Name: (2S)-2-amino-3-hydroxy-N-[(1S)-3-methyl-1-[(E)-2-methylsulfonylvinyl]butyl]propanamide CAS Name: (2S)-2-amino-3-hydroxy-N-[(E,3S)-5-methyl-1-methylsulfonylhex-1-en-3-yl]propanamide IUPAC Name: (2S)-2-amino-3-hydroxy-N-[(E,3S)-5-methyl-1-methylsulfonylhex-1-en-3-yl]propanamide Traditional Name: (2S)-2-amino-3-hydroxy-N-[(E,1S)-1-isobutyl-3-mesyl-allyl]propionamide Formula: C11H22N2O4S MolecularWeight: 278.36838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=CS(=O)(=O)C)NC(=O)C(CO)N

Isomeric SMILES

CC(C)C[C@@H](/C=C/S(=O)(=O)C)NC(=O)[C@H](CO)N

InChI

InChI=1S/C11H22N2O4S/c1-8(2)6-9(4-5-18(3,16)17)13-11(15)10(12)7-14/h4-5,8-10,14H,6-7,12H2,1-3H3,(H,13,15)/b5-4+/t9-,10+/m1/s1