2-[4-(2-azanylethoxy)-3-(methylsulfonylamino)phenyl]-N-[3-(4-tert-butylcyclohexyl)phenyl]ethanamide hydrochloride

Systemtic Name: 2-[4-(2-azanylethoxy)-3-(methylsulfonylamino)phenyl]-N-[3-(4-tert-butylcyclohexyl)phenyl]ethanamide hydrochloride Openeye Name: 2-[4-(2-aminoethoxy)-3-(methanesulfonamido)phenyl]-N-[3-(4-tert-butylcyclohexyl)phenyl]acetamide hydrochloride CAS Name: 2-[4-(2-aminoethoxy)-3-(methanesulfonamido)phenyl]-N-[3-(4-tert-butylcyclohexyl)phenyl]acetamide hydrochloride IUPAC Name: 2-[4-(2-aminoethoxy)-3-(methanesulfonamido)phenyl]-N-[3-(4-tert-butylcyclohexyl)phenyl]acetamide hydrochloride Traditional Name: 2-[4-(2-aminoethoxy)-3-(methanesulfonamido)phenyl]-N-[3-(4-tert-butylcyclohexyl)phenyl]acetamide hydrochloride Formula: C27H40ClN3O4S MolecularWeight: 538.1422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C2=CC(=CC=C2)NC(=O)CC3=CC(=C(C=C3)OCCN)NS(=O)(=O)C.Cl

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C2=CC(=CC=C2)NC(=O)CC3=CC(=C(C=C3)OCCN)NS(=O)(=O)C.Cl

InChI

InChI=1S/C27H39N3O4S.ClH/c1-27(2,3)22-11-9-20(10-12-22)21-6-5-7-23(18-21)29-26(31)17-19-8-13-25(34-15-14-28)24(16-19)30-35(4,32)33;/h5-8,13,16,18,20,22,30H,9-12,14-15,17,28H2,1-4H3,(H,29,31);1H