4-bromanyl-3-chloranyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 4-bromanyl-3-chloranyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 4-bromo-3-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzothiophene-2-carboxamide CAS Name: 4-bromo-3-chloro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-bromo-3-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 4-bromo-3-chloro-N-(4-pyrrolidinosulfonylphenyl)benzothiophene-2-carboxamide Formula: C19H16BrClN2O3S2 MolecularWeight: 499.82894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C=CC=C4Br)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C=CC=C4Br)Cl

InChI

InChI=1S/C19H16BrClN2O3S2/c20-14-4-3-5-15-16(14)17(21)18(27-15)19(24)22-12-6-8-13(9-7-12)28(25,26)23-10-1-2-11-23/h3-9H,1-2,10-11H2,(H,22,24)