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

Systemtic Name: methyl 4-[[2-(phenylmethyl)-1,3-thiazol-4-yl]carbonylamino]butanoate Openeye Name: methyl 4-[(2-benzylthiazole-4-carbonyl)amino]butanoate CAS Name: 4-[[oxo-[2-(phenylmethyl)-4-thiazolyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(2-benzyl-1,3-thiazole-4-carbonyl)amino]butanoate Traditional Name: 4-[(2-benzylthiazole-4-carbonyl)amino]butyric acid methyl ester Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=CSC(=N1)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCCNC(=O)C1=CSC(=N1)CC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O3S/c1-21-15(19)8-5-9-17-16(20)13-11-22-14(18-13)10-12-6-3-2-4-7-12/h2-4,6-7,11H,5,8-10H2,1H3,(H,17,20)