3-chloranyl-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[2-(1-piperidylsulfonyl)phenyl]methyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(2-piperidinosulfonylbenzyl)benzothiophene-2-carboxamide Formula: C21H21ClN2O3S2 MolecularWeight: 448.98604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H21ClN2O3S2/c22-19-16-9-3-4-10-17(16)28-20(19)21(25)23-14-15-8-2-5-11-18(15)29(26,27)24-12-6-1-7-13-24/h2-5,8-11H,1,6-7,12-14H2,(H,23,25)