(3S)-N-(5-chloranyl-2,4-dimethoxy-phenyl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(5-chloranyl-2,4-dimethoxy-phenyl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(5-chloro-2,4-dimethoxy-phenyl)-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: (3S)-N-(5-chloro-2,4-dimethoxyphenyl)-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-(5-chloro-2,4-dimethoxyphenyl)-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(5-chloro-2,4-dimethoxy-phenyl)-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C19H23ClN2O5S2 MolecularWeight: 458.97932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)NC3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C19H23ClN2O5S2/c1-12-6-7-18(28-12)29(24,25)22-8-4-5-13(11-22)19(23)21-15-9-14(20)16(26-2)10-17(15)27-3/h6-7,9-10,13H,4-5,8,11H2,1-3H3,(H,21,23)/t13-/m0/s1