N-(1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[2-(1-pyrazolyl)ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)-4-pyrrolidinosulfonyl-benzamide Formula: C23H23N5O3S2 MolecularWeight: 481.59042

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN3C=CC=N3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN3C=CC=N3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H23N5O3S2/c29-22(18-8-10-19(11-9-18)33(30,31)27-14-3-4-15-27)28(17-16-26-13-5-12-24-26)23-25-20-6-1-2-7-21(20)32-23/h1-2,5-13H,3-4,14-17H2