2-chloranyl-N-[(1,5-dimethylpyrrol-2-yl)methyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[(1,5-dimethylpyrrol-2-yl)methyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[(1,5-dimethylpyrrol-2-yl)methyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[(1,5-dimethyl-2-pyrrolyl)methyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[(1,5-dimethylpyrrol-2-yl)methyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[(1,5-dimethylpyrrol-2-yl)methyl]-5-piperidinosulfonyl-benzamide Formula: C19H24ClN3O3S MolecularWeight: 409.93016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CC1=CC=C(N1C)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C19H24ClN3O3S/c1-14-6-7-15(22(14)2)13-21-19(24)17-12-16(8-9-18(17)20)27(25,26)23-10-4-3-5-11-23/h6-9,12H,3-5,10-11,13H2,1-2H3,(H,21,24)