3-[[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]methylideneamino]-4-methyl-N-prop-2-enyl-1,3-thiazol-2-imine

Systemtic Name: 3-[[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]methylideneamino]-4-methyl-N-prop-2-enyl-1,3-thiazol-2-imine Openeye Name: N-allyl-3-[[2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)pyrrol-3-yl]methyleneamino]-4-methyl-thiazol-2-imine CAS Name: 3-[[2,5-dimethyl-1-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-3-pyrrolyl]methylideneamino]-4-methyl-N-prop-2-enyl-2-thiazolimine IUPAC Name: 3-[[2,5-dimethyl-1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)pyrrol-3-yl]methylideneamino]-4-methyl-N-prop-2-enyl-1,3-thiazol-2-imine Traditional Name: allyl-[3-[[2,5-dimethyl-1-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)pyrrol-3-yl]methyleneamino]-4-methyl-4-thiazolin-2-ylidene]amine Formula: C28H36N6O3S2 MolecularWeight: 568.75384

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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(=CSC5=NCC=C)C

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)C)C=NN5C(=CSC5=NCC=C)C

InChI

InChI=1S/C28H36N6O3S2/c1-5-10-29-28-34(22(3)20-38-28)30-19-24-17-21(2)33(23(24)4)27-18-25(8-9-26(27)31-11-6-7-12-31)39(35,36)32-13-15-37-16-14-32/h5,8-9,17-20H,1,6-7,10-16H2,2-4H3