2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carboxamide

Systemtic Name: 2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carboxamide Openeye Name: 2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxo-ethyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carboxamide CAS Name: 2-[[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxoethyl]thio]-4,5,6-trimethyl-3-pyridinecarboxamide IUPAC Name: 2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxoethyl]sulfanyl-4,5,6-trimethylpyridine-3-carboxamide Traditional Name: 2-[[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-keto-ethyl]thio]-4,5,6-trimethyl-nicotinamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C(=O)N)SCC(=O)N(C)CC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C(=O)N)SCC(=O)N(C)CC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C20H22N4O2S2/c1-11-12(2)18(19(21)26)20(22-13(11)3)27-10-17(25)24(4)9-16-23-14-7-5-6-8-15(14)28-16/h5-8H,9-10H2,1-4H3,(H2,21,26)