2-[2-(2-benzamido-1,3-thiazol-4-yl)ethanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-(2-benzamido-1,3-thiazol-4-yl)ethanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-(2-benzamidothiazol-4-yl)acetyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-(2-benzamido-4-thiazolyl)-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-(2-benzamido-1,3-thiazol-4-yl)acetyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-(2-benzamidothiazol-4-yl)acetyl]amino]-4-methyl-valeric acid Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CC1=CSC(=N1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)CC1=CSC(=N1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21N3O4S/c1-11(2)8-14(17(24)25)20-15(22)9-13-10-26-18(19-13)21-16(23)12-6-4-3-5-7-12/h3-7,10-11,14H,8-9H2,1-2H3,(H,20,22)(H,24,25)(H,19,21,23)