methyl 2-[[4-(morpholin-4-ylcarbonylamino)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoate

Systemtic Name: methyl 2-[[4-(morpholin-4-ylcarbonylamino)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoate Openeye Name: methyl 2-[[4-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoate CAS Name: 2-[[4-[[4-morpholinyl(oxo)methyl]amino]phenyl]sulfonylamino]-5-phenyl-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[[4-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-5-phenylpent-4-ynoate Traditional Name: 2-[[4-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid methyl ester Formula: C23H25N3O6S MolecularWeight: 471.5261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC#CC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C(CC#CC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)N3CCOCC3

InChI

InChI=1S/C23H25N3O6S/c1-31-22(27)21(9-5-8-18-6-3-2-4-7-18)25-33(29,30)20-12-10-19(11-13-20)24-23(28)26-14-16-32-17-15-26/h2-4,6-7,10-13,21,25H,9,14-17H2,1H3,(H,24,28)