5-chloranyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-mesyl-N-(6-methoxy-1,3-benzothiazol-2-yl)pyrimidine-4-carboxamide Formula: C14H11ClN4O4S2 MolecularWeight: 398.84454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)C

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)C

InChI

InChI=1S/C14H11ClN4O4S2/c1-23-7-3-4-9-10(5-7)24-13(17-9)19-12(20)11-8(15)6-16-14(18-11)25(2,21)22/h3-6H,1-2H3,(H,17,19,20)