1-[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]-N-isoquinolin-5-yl-methanimine

Systemtic Name: 1-[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]-N-isoquinolin-5-yl-methanimine Openeye Name: 1-[2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]-N-(5-isoquinolyl)methanimine CAS Name: 1-[2,5-dimethyl-1-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-3-pyrrolyl]-N-(5-isoquinolinyl)methanimine IUPAC Name: 1-[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)pyrrol-3-yl]-N-isoquinolin-5-ylmethanimine Traditional Name: [2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)pyrrol-3-yl]methylene-(5-isoquinolyl)amine Formula: C30H33N5O3S MolecularWeight: 543.67972

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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=CC=CC6=C5C=CN=C6

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)C)C=NC5=CC=CC6=C5C=CN=C6

InChI

InChI=1S/C30H33N5O3S/c1-22-18-25(21-32-28-7-5-6-24-20-31-11-10-27(24)28)23(2)35(22)30-19-26(8-9-29(30)33-12-3-4-13-33)39(36,37)34-14-16-38-17-15-34/h5-11,18-21H,3-4,12-17H2,1-2H3