methyl 4-[4-[[4-(propan-2-ylsulfonylamino)cyclohexyl]carbonylamino]phenyl]butanoate

Systemtic Name: methyl 4-[4-[[4-(propan-2-ylsulfonylamino)cyclohexyl]carbonylamino]phenyl]butanoate Openeye Name: methyl 4-[4-[[4-(isopropylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butanoate CAS Name: 4-[4-[[oxo-[4-(propan-2-ylsulfonylamino)cyclohexyl]methyl]amino]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butanoate Traditional Name: 4-[4-[[4-(isopropylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butyric acid methyl ester Formula: C21H32N2O5S MolecularWeight: 424.55418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NC1CCC(CC1)C(=O)NC2=CC=C(C=C2)CCCC(=O)OC

Isomeric SMILES

CC(C)S(=O)(=O)NC1CCC(CC1)C(=O)NC2=CC=C(C=C2)CCCC(=O)OC

InChI

InChI=1S/C21H32N2O5S/c1-15(2)29(26,27)23-19-13-9-17(10-14-19)21(25)22-18-11-7-16(8-12-18)5-4-6-20(24)28-3/h7-8,11-12,15,17,19,23H,4-6,9-10,13-14H2,1-3H3,(H,22,25)