N2-[[3-(aminomethyl)phenyl]methyl]-N1-(3-methylphenyl)-3-thiophen-2-ylsulfonyl-imidazolidine-1,2-dicarboxamide

Systemtic Name: N2-[[3-(aminomethyl)phenyl]methyl]-N1-(3-methylphenyl)-3-thiophen-2-ylsulfonyl-imidazolidine-1,2-dicarboxamide Openeye Name: N2-[[3-(aminomethyl)phenyl]methyl]-N1-(m-tolyl)-3-(2-thienylsulfonyl)imidazolidine-1,2-dicarboxamide CAS Name: N2-[[3-(aminomethyl)phenyl]methyl]-N1-(3-methylphenyl)-3-thiophen-2-ylsulfonylimidazolidine-1,2-dicarboxamide IUPAC Name: 2-N-[[3-(aminomethyl)phenyl]methyl]-1-N-(3-methylphenyl)-3-thiophen-2-ylsulfonylimidazolidine-1,2-dicarboxamide Traditional Name: N'-[3-(aminomethyl)benzyl]-N-(m-tolyl)-3-(2-thienylsulfonyl)imidazolidine-1,2-dicarboxamide Formula: C24H27N5O4S2 MolecularWeight: 513.63228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C24H27N5O4S2/c1-17-5-2-8-20(13-17)27-24(31)28-10-11-29(35(32,33)21-9-4-12-34-21)23(28)22(30)26-16-19-7-3-6-18(14-19)15-25/h2-9,12-14,23H,10-11,15-16,25H2,1H3,(H,26,30)(H,27,31)