N-[[3-(aminomethyl)phenyl]methyl]-1-cyclohexylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-1-cyclohexylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(cyclohexanecarbonyl)-3-(2-thienylsulfonyl)imidazolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-1-[cyclohexyl(oxo)methyl]-3-thiophen-2-ylsulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(cyclohexanecarbonyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carboxamide Traditional Name: N-[3-(aminomethyl)benzyl]-1-(cyclohexanecarbonyl)-3-(2-thienylsulfonyl)imidazolidine-2-carboxamide Formula: C23H30N4O4S2 MolecularWeight: 490.6387

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H30N4O4S2/c24-15-17-6-4-7-18(14-17)16-25-21(28)22-26(23(29)19-8-2-1-3-9-19)11-12-27(22)33(30,31)20-10-5-13-32-20/h4-7,10,13-14,19,22H,1-3,8-9,11-12,15-16,24H2,(H,25,28)