N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(4-methylsulfanylphenyl)ethanamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(4-methylsulfanylphenyl)ethanamide Openeye Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-2-(4-methylsulfanylphenyl)acetamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-2-[4-(methylthio)phenyl]acetamide IUPAC Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(4-methylsulfanylphenyl)acetamide Traditional Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-2-[4-(methylthio)phenyl]acetamide Formula: C22H19ClN2O3S2 MolecularWeight: 458.98086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CO3)C(=O)CC4=CC=C(C=C4)SC

Isomeric SMILES

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CO3)C(=O)CC4=CC=C(C=C4)SC

InChI

InChI=1S/C22H19ClN2O3S2/c1-27-18-10-9-17(23)21-20(18)24-22(30-21)25(13-15-4-3-11-28-15)19(26)12-14-5-7-16(29-2)8-6-14/h3-11H,12-13H2,1-2H3