N-(5-chloranylpyridin-2-yl)-3-[[4-(C-pyrrolidin-1-ylcarbonimidoyl)phenyl]carbonylamino]thiophene-2-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-3-[[4-(C-pyrrolidin-1-ylcarbonimidoyl)phenyl]carbonylamino]thiophene-2-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-3-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]thiophene-2-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-3-[[[4-[imino(1-pyrrolidinyl)methyl]phenyl]-oxomethyl]amino]-2-thiophenecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-3-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]thiophene-2-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-3-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]thiophene-2-carboxamide Formula: C22H20ClN5O2S MolecularWeight: 453.9445

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=N)C2=CC=C(C=C2)C(=O)NC3=C(SC=C3)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)C(=N)C2=CC=C(C=C2)C(=O)NC3=C(SC=C3)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5O2S/c23-16-7-8-18(25-13-16)27-22(30)19-17(9-12-31-19)26-21(29)15-5-3-14(4-6-15)20(24)28-10-1-2-11-28/h3-9,12-13,24H,1-2,10-11H2,(H,26,29)(H,25,27,30)