(2S)-2-acetamido-3-methyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)butanamide

Systemtic Name: (2S)-2-acetamido-3-methyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)butanamide Openeye Name: (2S)-2-acetamido-3-methyl-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]butanamide CAS Name: (2S)-2-acetamido-3-methyl-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]butanamide IUPAC Name: (2S)-2-acetamido-3-methyl-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)butanamide Traditional Name: (2S)-2-acetamido-3-methyl-N-(4-methyl-3-piperidinosulfonyl-phenyl)butyramide Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C(C)C)NC(=O)C)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C(C)C)NC(=O)C)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C19H29N3O4S/c1-13(2)18(20-15(4)23)19(24)21-16-9-8-14(3)17(12-16)27(25,26)22-10-6-5-7-11-22/h8-9,12-13,18H,5-7,10-11H2,1-4H3,(H,20,23)(H,21,24)/t18-/m0/s1