4-methyl-7-[methyl-[[3-(quinolin-2-ylmethoxy)phenyl]methyl]amino]-1,4-benzothiazin-3-one

Systemtic Name: 4-methyl-7-[methyl-[[3-(quinolin-2-ylmethoxy)phenyl]methyl]amino]-1,4-benzothiazin-3-one Openeye Name: 4-methyl-7-[methyl-[[3-(2-quinolylmethoxy)phenyl]methyl]amino]-1,4-benzothiazin-3-one CAS Name: 4-methyl-7-[methyl-[[3-(2-quinolinylmethoxy)phenyl]methyl]amino]-1,4-benzothiazin-3-one IUPAC Name: 4-methyl-7-[methyl-[[3-(quinolin-2-ylmethoxy)phenyl]methyl]amino]-1,4-benzothiazin-3-one Traditional Name: 4-methyl-7-[methyl-[3-(2-quinolylmethoxy)benzyl]amino]-1,4-benzothiazin-3-one Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CSC2=C1C=CC(=C2)N(C)CC3=CC(=CC=C3)OCC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CN1C(=O)CSC2=C1C=CC(=C2)N(C)CC3=CC(=CC=C3)OCC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H25N3O2S/c1-29(22-12-13-25-26(15-22)33-18-27(31)30(25)2)16-19-6-5-8-23(14-19)32-17-21-11-10-20-7-3-4-9-24(20)28-21/h3-15H,16-18H2,1-2H3