N2-(2-azanylethyl)-N1-(3-methylphenyl)-3-propylsulfonyl-imidazolidine-1,2-dicarboxamide

Systemtic Name: N2-(2-azanylethyl)-N1-(3-methylphenyl)-3-propylsulfonyl-imidazolidine-1,2-dicarboxamide Openeye Name: N2-(2-aminoethyl)-N1-(m-tolyl)-3-propylsulfonyl-imidazolidine-1,2-dicarboxamide CAS Name: N2-(2-aminoethyl)-N1-(3-methylphenyl)-3-propylsulfonylimidazolidine-1,2-dicarboxamide IUPAC Name: 2-N-(2-aminoethyl)-1-N-(3-methylphenyl)-3-propylsulfonylimidazolidine-1,2-dicarboxamide Traditional Name: N'-(2-aminoethyl)-N-(m-tolyl)-3-propylsulfonyl-imidazolidine-1,2-dicarboxamide Formula: C17H27N5O4S MolecularWeight: 397.49238

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(C1C(=O)NCCN)C(=O)NC2=CC=CC(=C2)C

Isomeric SMILES

CCCS(=O)(=O)N1CCN(C1C(=O)NCCN)C(=O)NC2=CC=CC(=C2)C

InChI

InChI=1S/C17H27N5O4S/c1-3-11-27(25,26)22-10-9-21(16(22)15(23)19-8-7-18)17(24)20-14-6-4-5-13(2)12-14/h4-6,12,16H,3,7-11,18H2,1-2H3,(H,19,23)(H,20,24)