N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(4-methyl-6-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(4-methyl-6-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(4-methyl-6-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[(4-methyl-6-oxo-1-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(4-methyl-6-oxo-1-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(6-keto-4-methyl-1-phenyl-pyrimidin-2-yl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C21H18N4O3S2 MolecularWeight: 438.52262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3S2/c1-13-10-19(27)25(14-6-4-3-5-7-14)21(22-13)29-12-18(26)24-20-23-16-9-8-15(28-2)11-17(16)30-20/h3-11H,12H2,1-2H3,(H,23,24,26)