(2S)-2-azanyl-N-[4-(4-hydroxyphenyl)-3-methyl-1,2-thiazol-5-yl]-4-methyl-pentanamide

Systemtic Name: (2S)-2-azanyl-N-[4-(4-hydroxyphenyl)-3-methyl-1,2-thiazol-5-yl]-4-methyl-pentanamide Openeye Name: (2S)-2-amino-N-[4-(4-hydroxyphenyl)-3-methyl-isothiazol-5-yl]-4-methyl-pentanamide CAS Name: (2S)-2-amino-N-[4-(4-hydroxyphenyl)-3-methyl-5-isothiazolyl]-4-methylpentanamide IUPAC Name: (2S)-2-amino-N-[4-(4-hydroxyphenyl)-3-methyl-1,2-thiazol-5-yl]-4-methylpentanamide Traditional Name: (2S)-2-amino-N-[4-(4-hydroxyphenyl)-3-methyl-isothiazol-5-yl]-4-methyl-valeramide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C2=CC=C(C=C2)O)NC(=O)C(CC(C)C)N

Isomeric SMILES

CC1=NSC(=C1C2=CC=C(C=C2)O)NC(=O)[C@H](CC(C)C)N

InChI

InChI=1S/C16H21N3O2S/c1-9(2)8-13(17)15(21)18-16-14(10(3)19-22-16)11-4-6-12(20)7-5-11/h4-7,9,13,20H,8,17H2,1-3H3,(H,18,21)/t13-/m0/s1