2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-1-(2,3-dihydro-1,4-benzothiazin-4-yl)ethanone

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-1-(2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Openeye Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-1-(2,3-dihydro-1,4-benzothiazin-4-yl)ethanone CAS Name: 2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-1-(2,3-dihydro-1,4-benzothiazin-4-yl)ethanone IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-1-(2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Traditional Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-1-(2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)N3CCSC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)N3CCSC4=CC=CC=C43

InChI

InChI=1S/C23H29N3O4S2/c1-30-21-11-10-18(32(28,29)25-12-6-2-3-7-13-25)16-19(21)24-17-23(27)26-14-15-31-22-9-5-4-8-20(22)26/h4-5,8-11,16,24H,2-3,6-7,12-15,17H2,1H3