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

Systemtic Name: 3-methyl-N-[2-(2-methylpropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Openeye Name: N-(2-isobutylsulfanyl-1,3-benzothiazol-6-yl)-3-methyl-benzamide CAS Name: 3-methyl-N-[2-(2-methylpropylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3-methyl-N-[2-(2-methylpropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Traditional Name: N-[2-(isobutylthio)-1,3-benzothiazol-6-yl]-3-methyl-benzamide Formula: C19H20N2OS2 MolecularWeight: 356.5049

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(C)C

InChI

InChI=1S/C19H20N2OS2/c1-12(2)11-23-19-21-16-8-7-15(10-17(16)24-19)20-18(22)14-6-4-5-13(3)9-14/h4-10,12H,11H2,1-3H3,(H,20,22)