4-[2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-1,4-benzothiazin-3-one

Systemtic Name: 4-[2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-1,4-benzothiazin-3-one Openeye Name: 4-[2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]-1,4-benzothiazin-3-one CAS Name: 4-[2-[4-[(1-methyl-2-imidazolyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-1,4-benzothiazin-3-one IUPAC Name: 4-[2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-1,4-benzothiazin-3-one Traditional Name: 4-[2-keto-2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]ethyl]-1,4-benzothiazin-3-one Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN2CCCN(CC2)C(=O)CN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

CN1C=CN=C1CN2CCCN(CC2)C(=O)CN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C20H25N5O2S/c1-22-10-7-21-18(22)13-23-8-4-9-24(12-11-23)19(26)14-25-16-5-2-3-6-17(16)28-15-20(25)27/h2-3,5-7,10H,4,8-9,11-15H2,1H3