methyl 2-[[4-[(6-cyanopyridin-3-yl)carbonylamino]phenyl]sulfonylamino]-6-phenoxy-hex-4-ynoate

Systemtic Name: methyl 2-[[4-[(6-cyanopyridin-3-yl)carbonylamino]phenyl]sulfonylamino]-6-phenoxy-hex-4-ynoate Openeye Name: methyl 2-[[4-[(6-cyanopyridine-3-carbonyl)amino]phenyl]sulfonylamino]-6-phenoxy-hex-4-ynoate CAS Name: 2-[[4-[[(6-cyano-3-pyridinyl)-oxomethyl]amino]phenyl]sulfonylamino]-6-phenoxy-4-hexynoic acid methyl ester IUPAC Name: methyl 2-[[4-[(6-cyanopyridine-3-carbonyl)amino]phenyl]sulfonylamino]-6-phenoxyhex-4-ynoate Traditional Name: 2-[[4-[(6-cyanonicotinoyl)amino]phenyl]sulfonylamino]-6-phenoxy-hex-4-ynoic acid methyl ester Formula: C26H22N4O6S MolecularWeight: 518.54108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC#CCOC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CN=C(C=C3)C#N

Isomeric SMILES

COC(=O)C(CC#CCOC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CN=C(C=C3)C#N

InChI

InChI=1S/C26H22N4O6S/c1-35-26(32)24(9-5-6-16-36-22-7-3-2-4-8-22)30-37(33,34)23-14-12-20(13-15-23)29-25(31)19-10-11-21(17-27)28-18-19/h2-4,7-8,10-15,18,24,30H,9,16H2,1H3,(H,29,31)