N-(6-methyl-1,3-benzothiazol-2-yl)-2-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide Openeye Name: 2-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]acetamide IUPAC Name: 2-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=C(NC(=NC3=O)SCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=C(NC(=NC3=O)SCC4=CC=CC=C4)C

InChI

InChI=1S/C22H20N4O2S2/c1-13-8-9-17-18(10-13)30-22(24-17)25-19(27)11-16-14(2)23-21(26-20(16)28)29-12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,23,26,28)(H,24,25,27)