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

Systemtic Name: (2S)-2-azanyl-N-[(E,3S)-5-methyl-1-methylsulfonyl-hex-1-en-3-yl]-3-phenyl-propanamide Openeye Name: (2S)-2-amino-N-[(1S)-3-methyl-1-[(E)-2-methylsulfonylvinyl]butyl]-3-phenyl-propanamide CAS Name: (2S)-2-amino-N-[(E,3S)-5-methyl-1-methylsulfonylhex-1-en-3-yl]-3-phenylpropanamide IUPAC Name: (2S)-2-amino-N-[(E,3S)-5-methyl-1-methylsulfonylhex-1-en-3-yl]-3-phenylpropanamide Traditional Name: (2S)-2-amino-N-[(E,1S)-1-isobutyl-3-mesyl-allyl]-3-phenyl-propionamide Formula: C17H26N2O3S MolecularWeight: 338.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=CS(=O)(=O)C)NC(=O)C(CC1=CC=CC=C1)N

Isomeric SMILES

CC(C)C[C@@H](/C=C/S(=O)(=O)C)NC(=O)[C@H](CC1=CC=CC=C1)N

InChI

InChI=1S/C17H26N2O3S/c1-13(2)11-15(9-10-23(3,21)22)19-17(20)16(18)12-14-7-5-4-6-8-14/h4-10,13,15-16H,11-12,18H2,1-3H3,(H,19,20)/b10-9+/t15-,16+/m1/s1