1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidin-3-amine

Systemtic Name: 1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidin-3-amine Openeye Name: 1-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-N-ethyl-N-(4-pyridylmethyl)piperidin-3-amine CAS Name: 1-(4-chloro-2,5-dimethylphenyl)sulfonyl-N-ethyl-N-(pyridin-4-ylmethyl)-3-piperidinamine IUPAC Name: 1-(4-chloro-2,5-dimethylphenyl)sulfonyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidin-3-amine Traditional Name: [1-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-3-piperidyl]-ethyl-(4-pyridylmethyl)amine Formula: C21H28ClN3O2S MolecularWeight: 421.98392

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C2CCCN(C2)S(=O)(=O)C3=C(C=C(C(=C3)C)Cl)C

Isomeric SMILES

CCN(CC1=CC=NC=C1)C2CCCN(C2)S(=O)(=O)C3=C(C=C(C(=C3)C)Cl)C

InChI

InChI=1S/C21H28ClN3O2S/c1-4-24(14-18-7-9-23-10-8-18)19-6-5-11-25(15-19)28(26,27)21-13-16(2)20(22)12-17(21)3/h7-10,12-13,19H,4-6,11,14-15H2,1-3H3