3-[2-methyl-1-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)carbonyl-indolizin-3-yl]propanenitrile

Systemtic Name: 3-[2-methyl-1-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)carbonyl-indolizin-3-yl]propanenitrile Openeye Name: 3-[2-methyl-1-(2-methyl-5-morpholinosulfonyl-benzoyl)indolizin-3-yl]propanenitrile CAS Name: 3-[2-methyl-1-[[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-3-indolizinyl]propanenitrile IUPAC Name: 3-[2-methyl-1-(2-methyl-5-morpholin-4-ylsulfonylbenzoyl)indolizin-3-yl]propanenitrile Traditional Name: 3-[2-methyl-1-(2-methyl-5-morpholinosulfonyl-benzoyl)indolizin-3-yl]propionitrile Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)C3=C4C=CC=CN4C(=C3C)CCC#N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)C3=C4C=CC=CN4C(=C3C)CCC#N

InChI

InChI=1S/C24H25N3O4S/c1-17-8-9-19(32(29,30)26-12-14-31-15-13-26)16-20(17)24(28)23-18(2)21(7-5-10-25)27-11-4-3-6-22(23)27/h3-4,6,8-9,11,16H,5,7,12-15H2,1-2H3