ethyl 2-[2-[(1-oxidanylideneisothiochromen-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(1-oxidanylideneisothiochromen-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(1-oxoisothiochromene-3-carbonyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[oxo-(1-oxo-2-benzothiopyran-3-yl)methyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(1-oxoisothiochromene-3-carbonyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(1-ketoisothiochromene-3-carbonyl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C17H14N2O4S2 MolecularWeight: 374.43406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC3=CC=CC=C3C(=O)S2

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC3=CC=CC=C3C(=O)S2

InChI

InChI=1S/C17H14N2O4S2/c1-2-23-14(20)8-11-9-24-17(18-11)19-15(21)13-7-10-5-3-4-6-12(10)16(22)25-13/h3-7,9H,2,8H2,1H3,(H,18,19,21)