N-(4-azanylcyclohexyl)-1-(3-methylphenyl)carbonyl-3-propylsulfonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(3-methylphenyl)carbonyl-3-propylsulfonyl-imidazolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(3-methylbenzoyl)-3-propylsulfonyl-imidazolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(3-methylphenyl)-oxomethyl]-3-propylsulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(3-methylbenzoyl)-3-propylsulfonylimidazolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-m-toluoyl-3-propylsulfonyl-imidazolidine-2-carboxamide Formula: C21H32N4O4S MolecularWeight: 436.56818

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(C1C(=O)NC2CCC(CC2)N)C(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCCS(=O)(=O)N1CCN(C1C(=O)NC2CCC(CC2)N)C(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C21H32N4O4S/c1-3-13-30(28,29)25-12-11-24(21(27)16-6-4-5-15(2)14-16)20(25)19(26)23-18-9-7-17(22)8-10-18/h4-6,14,17-18,20H,3,7-13,22H2,1-2H3,(H,23,26)