3-methyl-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-2-(2-phenylethanoylamino)butanamide

Systemtic Name: 3-methyl-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-2-(2-phenylethanoylamino)butanamide Openeye Name: 3-methyl-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]-2-[(2-phenylacetyl)amino]butanamide CAS Name: 3-methyl-N-[4-methyl-5-(1-methyl-2-imidazolyl)-2-thiazolyl]-2-[(1-oxo-2-phenylethyl)amino]butanamide IUPAC Name: 3-methyl-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-2-[(2-phenylacetyl)amino]butanamide Traditional Name: 3-methyl-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]-2-[(2-phenylacetyl)amino]butyramide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C(C(C)C)NC(=O)CC2=CC=CC=C2)C3=NC=CN3C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(C(C)C)NC(=O)CC2=CC=CC=C2)C3=NC=CN3C

InChI

InChI=1S/C21H25N5O2S/c1-13(2)17(24-16(27)12-15-8-6-5-7-9-15)20(28)25-21-23-14(3)18(29-21)19-22-10-11-26(19)4/h5-11,13,17H,12H2,1-4H3,(H,24,27)(H,23,25,28)