3,4-dimethoxy-N-[2-(2-methylpropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[2-(2-methylpropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Openeye Name: N-(2-isobutylsulfanyl-1,3-benzothiazol-6-yl)-3,4-dimethoxy-benzamide CAS Name: 3,4-dimethoxy-N-[2-(2-methylpropylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3,4-dimethoxy-N-[2-(2-methylpropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Traditional Name: N-[2-(isobutylthio)-1,3-benzothiazol-6-yl]-3,4-dimethoxy-benzamide Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H22N2O3S2/c1-12(2)11-26-20-22-15-7-6-14(10-18(15)27-20)21-19(23)13-5-8-16(24-3)17(9-13)25-4/h5-10,12H,11H2,1-4H3,(H,21,23)