2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-phenethyl-amino]-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-phenethyl-amino]-N-(3-methylbutyl)ethanamide Openeye Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-phenethyl-amino]-N-isopentyl-acetamide CAS Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-phenethylamino]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-phenethylamino]-N-(3-methylbutyl)acetamide Traditional Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-phenethyl-amino]-N-isoamyl-acetamide Formula: C22H29ClN2O4S MolecularWeight: 452.99466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

CC(C)CCNC(=O)CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C22H29ClN2O4S/c1-17(2)11-13-24-22(26)16-25(14-12-18-7-5-4-6-8-18)30(27,28)19-9-10-21(29-3)20(23)15-19/h4-10,15,17H,11-14,16H2,1-3H3,(H,24,26)