5-[[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]methylideneamino]-1,3-dihydrobenzimidazol-2-one

Systemtic Name: 5-[[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]methylideneamino]-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-[[2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]methyleneamino]-1,3-dihydrobenzimidazol-2-one CAS Name: 5-[[2,5-dimethyl-1-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-3-pyrrolyl]methylideneamino]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-[[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)pyrrol-3-yl]methylideneamino]-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-[[2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)pyrrol-3-yl]methyleneamino]-1,3-dihydrobenzimidazol-2-one Formula: C28H32N6O4S MolecularWeight: 548.65648

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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=NC5=CC6=C(C=C5)NC(=O)N6

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)C)C=NC5=CC6=C(C=C5)NC(=O)N6

InChI

InChI=1S/C28H32N6O4S/c1-19-15-21(18-29-22-5-7-24-25(16-22)31-28(35)30-24)20(2)34(19)27-17-23(6-8-26(27)32-9-3-4-10-32)39(36,37)33-11-13-38-14-12-33/h5-8,15-18H,3-4,9-14H2,1-2H3,(H2,30,31,35)