methyl 2-[6-ethyl-2-[(3-methyl-1,2-oxazol-5-yl)carbonylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-ethyl-2-[(3-methyl-1,2-oxazol-5-yl)carbonylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-ethyl-2-(3-methylisoxazole-5-carbonyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-ethyl-2-[(3-methyl-5-isoxazolyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-ethyl-2-(3-methyl-1,2-oxazole-5-carbonyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-ethyl-2-(3-methylisoxazole-5-carbonyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=NO3)C)S2)CC(=O)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=NO3)C)S2)CC(=O)OC

InChI

InChI=1S/C17H17N3O4S/c1-4-11-5-6-12-14(8-11)25-17(20(12)9-15(21)23-3)18-16(22)13-7-10(2)19-24-13/h5-8H,4,9H2,1-3H3