methyl 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-(3-morpholin-4-ylphenyl)pent-4-ynoate

Systemtic Name: methyl 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-(3-morpholin-4-ylphenyl)pent-4-ynoate Openeye Name: methyl 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-(3-morpholinophenyl)pent-4-ynoate CAS Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-[3-(4-morpholinyl)phenyl]-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-(3-morpholin-4-ylphenyl)pent-4-ynoate Traditional Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-(3-morpholinophenyl)pent-4-ynoic acid methyl ester Formula: C29H30N2O6S MolecularWeight: 534.6233

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC(=CC=C3)N4CCOCC4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC(=CC=C3)N4CCOCC4)C(=O)OC

InChI

InChI=1S/C29H30N2O6S/c1-35-26-13-9-23(10-14-26)24-11-15-27(16-12-24)38(33,34)30-28(29(32)36-2)8-4-6-22-5-3-7-25(21-22)31-17-19-37-20-18-31/h3,5,7,9-16,21,28,30H,8,17-20H2,1-2H3