3,5-dimethyl-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)-1H-pyrazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)-1H-pyrazole-4-sulfonamide Openeye Name: 3,5-dimethyl-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)-1H-pyrazole-4-sulfonamide CAS Name: 3,5-dimethyl-N-[2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]-1H-pyrazole-4-sulfonamide IUPAC Name: 3,5-dimethyl-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)-1H-pyrazole-4-sulfonamide Traditional Name: 3,5-dimethyl-N-(2-pyrrolidino-1,3-benzothiazol-6-yl)-1H-pyrazole-4-sulfonamide Formula: C16H19N5O2S2 MolecularWeight: 377.48436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4

InChI

InChI=1S/C16H19N5O2S2/c1-10-15(11(2)19-18-10)25(22,23)20-12-5-6-13-14(9-12)24-16(17-13)21-7-3-4-8-21/h5-6,9,20H,3-4,7-8H2,1-2H3,(H,18,19)