N-[[4-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]phenyl]methyl]-5-[[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]methyl]-N-methyl-1,3,4-oxadiazole-2-carboxamide

Systemtic Name: N-[[4-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]phenyl]methyl]-5-[[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]methyl]-N-methyl-1,3,4-oxadiazole-2-carboxamide Openeye Name: N-[[4-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]phenyl]methyl]-5-[[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]methyl]-N-methyl-1,3,4-oxadiazole-2-carboxamide CAS Name: N-[[4-[[3-(dimethylamino)-1-pyrrolidinyl]methyl]phenyl]methyl]-5-[[(4-methoxy-2,6-dimethylphenyl)sulfonyl-methylamino]methyl]-N-methyl-1,3,4-oxadiazole-2-carboxamide IUPAC Name: N-[[4-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]phenyl]methyl]-5-[[(4-methoxy-2,6-dimethylphenyl)sulfonyl-methylamino]methyl]-N-methyl-1,3,4-oxadiazole-2-carboxamide Traditional Name: N-[4-[[3-(dimethylamino)pyrrolidino]methyl]benzyl]-5-[[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]methyl]-N-methyl-1,3,4-oxadiazole-2-carboxamide Formula: C29H40N6O5S MolecularWeight: 584.7301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N(C)CC2=NN=C(O2)C(=O)N(C)CC3=CC=C(C=C3)CN4CCC(C4)N(C)C)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N(C)CC2=NN=C(O2)C(=O)N(C)CC3=CC=C(C=C3)CN4CCC(C4)N(C)C)C)OC

InChI

InChI=1S/C29H40N6O5S/c1-20-14-25(39-7)15-21(2)27(20)41(37,38)34(6)19-26-30-31-28(40-26)29(36)33(5)16-22-8-10-23(11-9-22)17-35-13-12-24(18-35)32(3)4/h8-11,14-15,24H,12-13,16-19H2,1-7H3