2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(2-morpholin-4-ylethanoylamino)pentanamide

Systemtic Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(2-morpholin-4-ylethanoylamino)pentanamide Openeye Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-[(2-morpholinoacetyl)amino]pentanamide CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-[[2-(4-morpholinyl)-1-oxoethyl]amino]pentanamide IUPAC Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-[(2-morpholin-4-ylacetyl)amino]pentanamide Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-[(2-morpholinoacetyl)amino]valeramide Formula: C21H30N4O6S MolecularWeight: 466.5511

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCCNC(=O)CN2CCOCC2)C(=O)N

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCCNC(=O)CN2CCOCC2)C(=O)N

InChI

InChI=1S/C21H30N4O6S/c1-2-3-13-31-17-6-8-18(9-7-17)32(28,29)24-19(21(22)27)5-4-10-23-20(26)16-25-11-14-30-15-12-25/h6-9,19,24H,4-5,10-16H2,1H3,(H2,22,27)(H,23,26)