N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(2,3,4-trimethoxyphenyl)ethanamide

Systemtic Name: N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(2,3,4-trimethoxyphenyl)ethanamide Openeye Name: N-[2-[2-(3-thienyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-2-(2,3,4-trimethoxyphenyl)acetamide CAS Name: N-[2-[2-(3-thiophenyl)ethylthio]-1,3-benzothiazol-6-yl]-2-(2,3,4-trimethoxyphenyl)acetamide IUPAC Name: N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(2,3,4-trimethoxyphenyl)acetamide Traditional Name: N-[2-[2-(3-thienyl)ethylthio]-1,3-benzothiazol-6-yl]-2-(2,3,4-trimethoxyphenyl)acetamide Formula: C24H24N2O4S3 MolecularWeight: 500.65336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC4=CSC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC4=CSC=C4)OC)OC

InChI

InChI=1S/C24H24N2O4S3/c1-28-19-7-4-16(22(29-2)23(19)30-3)12-21(27)25-17-5-6-18-20(13-17)33-24(26-18)32-11-9-15-8-10-31-14-15/h4-8,10,13-14H,9,11-12H2,1-3H3,(H,25,27)