methyl 2-[[5-(4-methoxyphenyl)thiophen-2-yl]sulfonylamino]-5-phenyl-pent-4-ynoate

Systemtic Name: methyl 2-[[5-(4-methoxyphenyl)thiophen-2-yl]sulfonylamino]-5-phenyl-pent-4-ynoate Openeye Name: methyl 2-[[5-(4-methoxyphenyl)-2-thienyl]sulfonylamino]-5-phenyl-pent-4-ynoate CAS Name: 2-[[5-(4-methoxyphenyl)-2-thiophenyl]sulfonylamino]-5-phenyl-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[[5-(4-methoxyphenyl)thiophen-2-yl]sulfonylamino]-5-phenylpent-4-ynoate Traditional Name: 2-[[5-(4-methoxyphenyl)-2-thienyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid methyl ester Formula: C23H21NO5S2 MolecularWeight: 455.54654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H21NO5S2/c1-28-19-13-11-18(12-14-19)21-15-16-22(30-21)31(26,27)24-20(23(25)29-2)10-6-9-17-7-4-3-5-8-17/h3-5,7-8,11-16,20,24H,10H2,1-2H3