methyl 2-[[5-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-1,2-oxazol-3-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[5-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-1,2-oxazol-3-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[5-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]isoxazole-3-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[5-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-3-isoxazolyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[5-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]-1,2-oxazole-3-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[5-[(2-methyl-1,3-benzothiazol-5-yl)oxymethyl]isoxazole-3-carbonyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C19H21N3O5S2 MolecularWeight: 435.51714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)OCC3=CC(=NO3)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)OCC3=CC(=NO3)C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C19H21N3O5S2/c1-11-20-15-8-12(4-5-17(15)29-11)26-10-13-9-16(22-27-13)18(23)21-14(6-7-28-3)19(24)25-2/h4-5,8-9,14H,6-7,10H2,1-3H3,(H,21,23)