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

Systemtic Name: methyl 2-[[4-(4-methoxyphenyl)sulfonylthiophen-2-yl]sulfonylamino]-5-phenyl-pent-4-ynoate Openeye Name: methyl 2-[[4-(4-methoxyphenyl)sulfonyl-2-thienyl]sulfonylamino]-5-phenyl-pent-4-ynoate CAS Name: 2-[[4-(4-methoxyphenyl)sulfonyl-2-thiophenyl]sulfonylamino]-5-phenyl-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[[4-(4-methoxyphenyl)sulfonylthiophen-2-yl]sulfonylamino]-5-phenylpent-4-ynoate Traditional Name: 2-[[4-(4-methoxyphenyl)sulfonyl-2-thienyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid methyl ester Formula: C23H21NO7S3 MolecularWeight: 519.61034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21NO7S3/c1-30-18-11-13-19(14-12-18)33(26,27)20-15-22(32-16-20)34(28,29)24-21(23(25)31-2)10-6-9-17-7-4-3-5-8-17/h3-5,7-8,11-16,21,24H,10H2,1-2H3