ethyl 2-[4-[(4-chloranyl-1,3-benzothiazol-2-yl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(4-chloranyl-1,3-benzothiazol-2-yl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate Openeye Name: ethyl 2-[4-[(4-chloro-1,3-benzothiazol-2-yl)methyl]-3-oxo-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[4-[(4-chloro-1,3-benzothiazol-2-yl)methyl]-3-oxo-1,4-benzothiazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(4-chloro-1,3-benzothiazol-2-yl)methyl]-3-oxo-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[4-[(4-chloro-1,3-benzothiazol-2-yl)methyl]-3-keto-1,4-benzothiazin-2-yl]acetic acid ethyl ester Formula: C20H17ClN2O3S2 MolecularWeight: 432.94358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)N(C2=CC=CC=C2S1)CC3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

CCOC(=O)CC1C(=O)N(C2=CC=CC=C2S1)CC3=NC4=C(S3)C=CC=C4Cl

InChI

InChI=1S/C20H17ClN2O3S2/c1-2-26-18(24)10-16-20(25)23(13-7-3-4-8-14(13)27-16)11-17-22-19-12(21)6-5-9-15(19)28-17/h3-9,16H,2,10-11H2,1H3