2-[ethoxycarbonyl-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[ethoxycarbonyl-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[ethoxycarbonyl-[2-(2-phenylthiazol-4-yl)ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[ethoxycarbonyl-[2-(2-phenyl-4-thiazolyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[ethoxycarbonyl-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carbethoxy-[2-(2-phenylthiazol-4-yl)ethyl]amino]-4-methyl-valeric acid Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CCC1=CSC(=N1)C2=CC=CC=C2)C(CC(C)C)C(=O)O

Isomeric SMILES

CCOC(=O)N(CCC1=CSC(=N1)C2=CC=CC=C2)C(CC(C)C)C(=O)O

InChI

InChI=1S/C20H26N2O4S/c1-4-26-20(25)22(17(19(23)24)12-14(2)3)11-10-16-13-27-18(21-16)15-8-6-5-7-9-15/h5-9,13-14,17H,4,10-12H2,1-3H3,(H,23,24)