2-[4-(5-bromanylpentoxy)phenyl]-7-chloranyl-4-methyl-1,4-benzothiazin-3-one

Systemtic Name: 2-[4-(5-bromanylpentoxy)phenyl]-7-chloranyl-4-methyl-1,4-benzothiazin-3-one Openeye Name: 2-[4-(5-bromopentoxy)phenyl]-7-chloro-4-methyl-1,4-benzothiazin-3-one CAS Name: 2-[4-(5-bromopentoxy)phenyl]-7-chloro-4-methyl-1,4-benzothiazin-3-one IUPAC Name: 2-[4-(5-bromopentoxy)phenyl]-7-chloro-4-methyl-1,4-benzothiazin-3-one Traditional Name: 2-[4-(5-bromopentoxy)phenyl]-7-chloro-4-methyl-1,4-benzothiazin-3-one Formula: C20H21BrClNO2S MolecularWeight: 454.80824

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)SC(C1=O)C3=CC=C(C=C3)OCCCCCBr

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)SC(C1=O)C3=CC=C(C=C3)OCCCCCBr

InChI

InChI=1S/C20H21BrClNO2S/c1-23-17-10-7-15(22)13-18(17)26-19(20(23)24)14-5-8-16(9-6-14)25-12-4-2-3-11-21/h5-10,13,19H,2-4,11-12H2,1H3