3-tert-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-propan-2-yl-pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-propan-2-yl-pyrazole-4-sulfonamide Openeye Name: 3-tert-butyl-1-isopropyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-propan-2-yl-4-pyrazolesulfonamide IUPAC Name: 3-tert-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-propan-2-ylpyrazole-4-sulfonamide Traditional Name: 3-tert-butyl-1-isopropyl-N-(6-mesyl-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide Formula: C18H24N4O4S3 MolecularWeight: 456.60256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C(=N1)C(C)(C)C)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)N1C=C(C(=N1)C(C)(C)C)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H24N4O4S3/c1-11(2)22-10-15(16(20-22)18(3,4)5)29(25,26)21-17-19-13-8-7-12(28(6,23)24)9-14(13)27-17/h7-11H,1-6H3,(H,19,21)