N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-cyano-benzamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-cyano-benzamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-cyano-benzamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-3-cyanobenzamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-3-cyanobenzamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-3-cyano-benzamide Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=CC=CC(=C3)C#N)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=CC=CC(=C3)C#N)Cl

InChI

InChI=1S/C18H16ClN3O3S/c19-16-7-6-15(11-17(16)26(24,25)22-8-1-2-9-22)21-18(23)14-5-3-4-13(10-14)12-20/h3-7,10-11H,1-2,8-9H2,(H,21,23)