N-[[3-(aminomethyl)phenyl]methyl]-1-morpholin-4-ylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-1-morpholin-4-ylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(morpholine-4-carbonyl)-3-(2-thienylsulfonyl)imidazolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-1-[4-morpholinyl(oxo)methyl]-3-thiophen-2-ylsulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(morpholine-4-carbonyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carboxamide Traditional Name: N-[3-(aminomethyl)benzyl]-1-(morpholine-4-carbonyl)-3-(2-thienylsulfonyl)imidazolidine-2-carboxamide Formula: C21H27N5O5S2 MolecularWeight: 493.59958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N1C(=O)N2CCOCC2)C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(C(N1C(=O)N2CCOCC2)C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H27N5O5S2/c22-14-16-3-1-4-17(13-16)15-23-19(27)20-25(21(28)24-8-10-31-11-9-24)6-7-26(20)33(29,30)18-5-2-12-32-18/h1-5,12-13,20H,6-11,14-15,22H2,(H,23,27)