2-[2-[2-(3-chloranylpropoxy)-5-methoxy-phenyl]-3-oxidanylidene-1,4-benzothiazin-4-yl]ethanamide

Systemtic Name: 2-[2-[2-(3-chloranylpropoxy)-5-methoxy-phenyl]-3-oxidanylidene-1,4-benzothiazin-4-yl]ethanamide Openeye Name: 2-[2-[2-(3-chloropropoxy)-5-methoxy-phenyl]-3-oxo-1,4-benzothiazin-4-yl]acetamide CAS Name: 2-[2-[2-(3-chloropropoxy)-5-methoxyphenyl]-3-oxo-1,4-benzothiazin-4-yl]acetamide IUPAC Name: 2-[2-[2-(3-chloropropoxy)-5-methoxyphenyl]-3-oxo-1,4-benzothiazin-4-yl]acetamide Traditional Name: 2-[2-[2-(3-chloropropoxy)-5-methoxy-phenyl]-3-keto-1,4-benzothiazin-4-yl]acetamide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCCCCl)C2C(=O)N(C3=CC=CC=C3S2)CC(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)OCCCCl)C2C(=O)N(C3=CC=CC=C3S2)CC(=O)N

InChI

InChI=1S/C20H21ClN2O4S/c1-26-13-7-8-16(27-10-4-9-21)14(11-13)19-20(25)23(12-18(22)24)15-5-2-3-6-17(15)28-19/h2-3,5-8,11,19H,4,9-10,12H2,1H3,(H2,22,24)