N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithiolan-2-yl)-N-methyl-benzamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithiolan-2-yl)-N-methyl-benzamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithiolan-2-yl)-N-methyl-benzamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithiolan-2-yl)-N-methylbenzamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithiolan-2-yl)-N-methylbenzamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithiolan-2-yl)-N-methyl-benzamide Formula: C20H20N2OS3 MolecularWeight: 400.5806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C20H20N2OS3/c1-13(18-21-16-5-3-4-6-17(16)26-18)22(2)19(23)14-7-9-15(10-8-14)20-24-11-12-25-20/h3-10,13,20H,11-12H2,1-2H3