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

Systemtic Name: methyl 2-[(5-bromanylthiophen-2-yl)sulfonylamino]-5-phenyl-pent-4-ynoate Openeye Name: methyl 2-[(5-bromo-2-thienyl)sulfonylamino]-5-phenyl-pent-4-ynoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]-5-phenyl-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[(5-bromothiophen-2-yl)sulfonylamino]-5-phenylpent-4-ynoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]-5-phenyl-pent-4-ynoic acid methyl ester Formula: C16H14BrNO4S2 MolecularWeight: 428.32066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC#CC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC(=O)C(CC#CC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C16H14BrNO4S2/c1-22-16(19)13(9-5-8-12-6-3-2-4-7-12)18-24(20,21)15-11-10-14(17)23-15/h2-4,6-7,10-11,13,18H,9H2,1H3