4-chloranyl-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]-3-pyrrolidinosulfonyl-benzamide Formula: C20H20ClN5O3S MolecularWeight: 445.9225

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CN=C(C=C3)N4C=CC=N4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CN=C(C=C3)N4C=CC=N4)Cl

InChI

InChI=1S/C20H20ClN5O3S/c21-17-6-5-16(12-18(17)30(28,29)25-9-1-2-10-25)20(27)23-14-15-4-7-19(22-13-15)26-11-3-8-24-26/h3-8,11-13H,1-2,9-10,14H2,(H,23,27)