1,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 1,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 1,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide CAS Name: 1,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-pyrazolecarboxamide IUPAC Name: 1,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-1,3-dimethyl-pyrazole-4-carboxamide Formula: C14H14N4O3S2 MolecularWeight: 350.41596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=NN(C=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C14H14N4O3S2/c1-8-10(7-18(2)17-8)13(19)16-14-15-11-5-4-9(23(3,20)21)6-12(11)22-14/h4-7H,1-3H3,(H,15,16,19)