(2S)-2-[[(2-cyclopentyl-1,3-thiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[(2-cyclopentyl-1,3-thiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[(2-cyclopentylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[[(2-cyclopentyl-4-thiazolyl)methyl-methylamino]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[(2-cyclopentyl-1,3-thiazol-4-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[(2-cyclopentylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butyric acid Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)N(C)CC1=CSC(=N1)C2CCCC2

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)N(C)CC1=CSC(=N1)C2CCCC2

InChI

InChI=1S/C16H25N3O3S/c1-10(2)13(15(20)21)18-16(22)19(3)8-12-9-23-14(17-12)11-6-4-5-7-11/h9-11,13H,4-8H2,1-3H3,(H,18,22)(H,20,21)/t13-/m0/s1