N-[5-chloranyl-2-(dimethylamino)phenyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[5-chloranyl-2-(dimethylamino)phenyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[5-chloro-2-(dimethylamino)phenyl]-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[5-chloro-2-(dimethylamino)phenyl]-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[5-chloro-2-(dimethylamino)phenyl]-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[5-chloro-2-(dimethylamino)phenyl]-4-methyl-3-piperidinosulfonyl-benzamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)N(C)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)N(C)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H26ClN3O3S/c1-15-7-8-16(13-20(15)29(27,28)25-11-5-4-6-12-25)21(26)23-18-14-17(22)9-10-19(18)24(2)3/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,23,26)