N-(2-azanylethyl)-1-(3,4-dichlorophenyl)carbonyl-3-(5-nitrofuran-2-yl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3,4-dichlorophenyl)carbonyl-3-(5-nitrofuran-2-yl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3,4-dichlorobenzoyl)-3-(5-nitrofuran-2-carbonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(3,4-dichlorophenyl)-oxomethyl]-3-[(5-nitro-2-furanyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(3,4-dichlorobenzoyl)-3-(5-nitrofuran-2-carbonyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(3,4-dichlorobenzoyl)-3-(5-nitro-2-furoyl)hexahydropyrimidine-2-carboxamide Formula: C19H19Cl2N5O6 MolecularWeight: 484.29006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)C(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)NCCN)C(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(C(N(C1)C(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)NCCN)C(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H19Cl2N5O6/c20-12-3-2-11(10-13(12)21)18(28)24-8-1-9-25(17(24)16(27)23-7-6-22)19(29)14-4-5-15(32-14)26(30)31/h2-5,10,17H,1,6-9,22H2,(H,23,27)