(2R,3E)-6-chloranyl-2-ethoxy-3-[[(2-pentylsulfanyl-1,3-benzothiazol-6-yl)amino]methylidene]chromen-4-one

Systemtic Name: (2R,3E)-6-chloranyl-2-ethoxy-3-[[(2-pentylsulfanyl-1,3-benzothiazol-6-yl)amino]methylidene]chromen-4-one Openeye Name: (2R,3E)-6-chloro-2-ethoxy-3-[[(2-pentylsulfanyl-1,3-benzothiazol-6-yl)amino]methylene]chroman-4-one CAS Name: (2R,3E)-6-chloro-2-ethoxy-3-[[[2-(pentylthio)-1,3-benzothiazol-6-yl]amino]methylidene]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (2R,3E)-6-chloro-2-ethoxy-3-[[(2-pentylsulfanyl-1,3-benzothiazol-6-yl)amino]methylidene]chromen-4-one Traditional Name: (2R,3E)-3-[[[2-(amylthio)-1,3-benzothiazol-6-yl]amino]methylene]-6-chloro-2-ethoxy-chroman-4-one Formula: C24H25ClN2O3S2 MolecularWeight: 489.0499

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC2=C(S1)C=C(C=C2)NC=C3C(OC4=C(C3=O)C=C(C=C4)Cl)OCC

Isomeric SMILES

CCCCCSC1=NC2=C(S1)C=C(C=C2)N/C=C/3\[C@@H](OC4=C(C3=O)C=C(C=C4)Cl)OCC

InChI

InChI=1S/C24H25ClN2O3S2/c1-3-5-6-11-31-24-27-19-9-8-16(13-21(19)32-24)26-14-18-22(28)17-12-15(25)7-10-20(17)30-23(18)29-4-2/h7-10,12-14,23,26H,3-6,11H2,1-2H3/b18-14-/t23-/m1/s1