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

Systemtic Name: 3-[[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]methylideneamino]-2-methyl-quinazolin-4-one Openeye Name: 3-[[2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]methyleneamino]-2-methyl-quinazolin-4-one CAS Name: 3-[[2,5-dimethyl-1-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-3-pyrrolyl]methylideneamino]-2-methyl-4-quinazolinone IUPAC Name: 3-[[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)pyrrol-3-yl]methylideneamino]-2-methylquinazolin-4-one Traditional Name: 3-[[2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)pyrrol-3-yl]methyleneamino]-2-methyl-quinazolin-4-one Formula: C30H34N6O4S MolecularWeight: 574.69376

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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=NN5C(=NC6=CC=CC=C6C5=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)C)C=NN5C(=NC6=CC=CC=C6C5=O)C

InChI

InChI=1S/C30H34N6O4S/c1-21-18-24(20-31-36-23(3)32-27-9-5-4-8-26(27)30(36)37)22(2)35(21)29-19-25(10-11-28(29)33-12-6-7-13-33)41(38,39)34-14-16-40-17-15-34/h4-5,8-11,18-20H,6-7,12-17H2,1-3H3