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

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(4-bromophenyl)carbonyl-3-thiophen-2-ylsulfonyl-imidazolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(4-bromobenzoyl)-3-(2-thienylsulfonyl)imidazolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-1-[(4-bromophenyl)-oxomethyl]-3-thiophen-2-ylsulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(4-bromobenzoyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carboxamide Traditional Name: N-[3-(aminomethyl)benzyl]-1-(4-bromobenzoyl)-3-(2-thienylsulfonyl)imidazolidine-2-carboxamide Formula: C23H23BrN4O4S2 MolecularWeight: 563.48712

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N1C(=O)C2=CC=C(C=C2)Br)C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(C(N1C(=O)C2=CC=C(C=C2)Br)C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H23BrN4O4S2/c24-19-8-6-18(7-9-19)23(30)27-10-11-28(34(31,32)20-5-2-12-33-20)22(27)21(29)26-15-17-4-1-3-16(13-17)14-25/h1-9,12-13,22H,10-11,14-15,25H2,(H,26,29)