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

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-1-methylsulfonyl-3-thiophen-2-ylsulfonyl-imidazolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)phenyl]methyl]-1-methylsulfonyl-3-(2-thienylsulfonyl)imidazolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-1-methylsulfonyl-3-thiophen-2-ylsulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-1-methylsulfonyl-3-thiophen-2-ylsulfonylimidazolidine-2-carboxamide Traditional Name: N-[3-(aminomethyl)benzyl]-1-mesyl-3-(2-thienylsulfonyl)imidazolidine-2-carboxamide Formula: C17H22N4O5S3 MolecularWeight: 458.57538

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(C1C(=O)NCC2=CC=CC(=C2)CN)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CS(=O)(=O)N1CCN(C1C(=O)NCC2=CC=CC(=C2)CN)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H22N4O5S3/c1-28(23,24)20-7-8-21(29(25,26)15-6-3-9-27-15)17(20)16(22)19-12-14-5-2-4-13(10-14)11-18/h2-6,9-10,17H,7-8,11-12,18H2,1H3,(H,19,22)