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

Systemtic Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[2-[(3-chlorophenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[2-[(3-chlorobenzyl)thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide Formula: C23H21ClN4O3S2 MolecularWeight: 501.02084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=C(NC(=NC3=O)SCC4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=C(NC(=NC3=O)SCC4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C23H21ClN4O3S2/c1-3-31-16-7-8-18-19(10-16)33-23(26-18)27-20(29)11-17-13(2)25-22(28-21(17)30)32-12-14-5-4-6-15(24)9-14/h4-10H,3,11-12H2,1-2H3,(H,25,28,30)(H,26,27,29)