methyl 4-[[4-methyl-2-(phenylmethyl)-1,3-thiazol-5-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[4-methyl-2-(phenylmethyl)-1,3-thiazol-5-yl]carbonylamino]butanoate Openeye Name: methyl 4-[(2-benzyl-4-methyl-thiazole-5-carbonyl)amino]butanoate CAS Name: 4-[[[4-methyl-2-(phenylmethyl)-5-thiazolyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(2-benzyl-4-methyl-1,3-thiazole-5-carbonyl)amino]butanoate Traditional Name: 4-[(2-benzyl-4-methyl-thiazole-5-carbonyl)amino]butyric acid methyl ester Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NCCCC(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NCCCC(=O)OC

InChI

InChI=1S/C17H20N2O3S/c1-12-16(17(21)18-10-6-9-15(20)22-2)23-14(19-12)11-13-7-4-3-5-8-13/h3-5,7-8H,6,9-11H2,1-2H3,(H,18,21)