2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-N-phosphonato-pyrrole-3-carboxamide

Systemtic Name: 2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-N-phosphonato-pyrrole-3-carboxamide Openeye Name: 2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-N-phosphonato-pyrrole-3-carboxamide CAS Name: 2,5-dimethyl-1-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-N-phosphonato-3-pyrrolecarboxamide IUPAC Name: 2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-N-phosphonatopyrrole-3-carboxamide Traditional Name: 2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)-N-phosphonato-pyrrole-3-carboxamide Formula: C21H27N4O7PS-2 MolecularWeight: 510.500441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)C)C(=O)NP(=O)([O-])[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)C)C(=O)NP(=O)([O-])[O-]

InChI

InChI=1S/C21H29N4O7PS/c1-15-13-18(21(26)22-33(27,28)29)16(2)25(15)20-14-17(5-6-19(20)23-7-3-4-8-23)34(30,31)24-9-11-32-12-10-24/h5-6,13-14H,3-4,7-12H2,1-2H3,(H3,22,26,27,28,29)/p-2