1-(1,3-benzothiazol-2-yl)-5-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-5-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrazole-3-carboxamide Openeye Name: 1-(1,3-benzothiazol-2-yl)-5-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrazole-3-carboxamide CAS Name: 1-(1,3-benzothiazol-2-yl)-5-phenyl-N-[2-(1-pyrrolidinyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 1-(1,3-benzothiazol-2-yl)-5-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrazole-3-carboxamide Traditional Name: 1-(1,3-benzothiazol-2-yl)-5-phenyl-N-(2-pyrrolidinoethyl)pyrazole-3-carboxamide Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC(=O)C2=NN(C(=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)CCNC(=O)C2=NN(C(=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H23N5OS/c29-22(24-12-15-27-13-6-7-14-27)19-16-20(17-8-2-1-3-9-17)28(26-19)23-25-18-10-4-5-11-21(18)30-23/h1-5,8-11,16H,6-7,12-15H2,(H,24,29)