3-[2-[(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-methyl-amino]phenyl]-N-(2-piperidin-1-ylethyl)prop-2-ynamide

Systemtic Name: 3-[2-[(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-methyl-amino]phenyl]-N-(2-piperidin-1-ylethyl)prop-2-ynamide Openeye Name: 3-[2-[(4-chloro-2,5-dimethyl-phenyl)sulfonyl-methyl-amino]phenyl]-N-[2-(1-piperidyl)ethyl]prop-2-ynamide CAS Name: 3-[2-[(4-chloro-2,5-dimethylphenyl)sulfonyl-methylamino]phenyl]-N-[2-(1-piperidinyl)ethyl]-2-propynamide IUPAC Name: 3-[2-[(4-chloro-2,5-dimethylphenyl)sulfonyl-methylamino]phenyl]-N-(2-piperidin-1-ylethyl)prop-2-ynamide Traditional Name: 3-[2-[(4-chloro-2,5-dimethyl-phenyl)sulfonyl-methyl-amino]phenyl]-N-(2-piperidinoethyl)propiolamide Formula: C25H30ClN3O3S MolecularWeight: 488.042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N(C)C2=CC=CC=C2C#CC(=O)NCCN3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N(C)C2=CC=CC=C2C#CC(=O)NCCN3CCCCC3

InChI

InChI=1S/C25H30ClN3O3S/c1-19-18-24(20(2)17-22(19)26)33(31,32)28(3)23-10-6-5-9-21(23)11-12-25(30)27-13-16-29-14-7-4-8-15-29/h5-6,9-10,17-18H,4,7-8,13-16H2,1-3H3,(H,27,30)