2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-(N-mesyl-2,5-dimethyl-anilino)-N-(4-piperidinosulfonylphenyl)propionamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S2/c1-17-8-9-18(2)22(16-17)26(32(4,28)29)19(3)23(27)24-20-10-12-21(13-11-20)33(30,31)25-14-6-5-7-15-25/h8-13,16,19H,5-7,14-15H2,1-4H3,(H,24,27)