N-[[3-(aminomethyl)phenyl]methyl]-1-(3-methylphenyl)carbonyl-3-(5-nitrofuran-2-yl)carbonyl-imidazolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(3-methylphenyl)carbonyl-3-(5-nitrofuran-2-yl)carbonyl-imidazolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(3-methylbenzoyl)-3-(5-nitrofuran-2-carbonyl)imidazolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-1-[(3-methylphenyl)-oxomethyl]-3-[(5-nitro-2-furanyl)-oxomethyl]-2-imidazolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(3-methylbenzoyl)-3-(5-nitrofuran-2-carbonyl)imidazolidine-2-carboxamide Traditional Name: N-[3-(aminomethyl)benzyl]-1-m-toluoyl-3-(5-nitro-2-furoyl)imidazolidine-2-carboxamide Formula: C25H25N5O6 MolecularWeight: 491.4959

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C25H25N5O6/c1-16-4-2-7-19(12-16)24(32)28-10-11-29(25(33)20-8-9-21(36-20)30(34)35)23(28)22(31)27-15-18-6-3-5-17(13-18)14-26/h2-9,12-13,23H,10-11,14-15,26H2,1H3,(H,27,31)