N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-N'-methyl-2-nitro-ethanimidamide

Systemtic Name: N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-N'-methyl-2-nitro-ethanimidamide Openeye Name: N-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethyl]-N'-methyl-2-nitro-acetamidine CAS Name: N-[2-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]ethyl]-N'-methyl-2-nitroethanimidamide IUPAC Name: N-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-N'-methyl-2-nitroethanimidamide Traditional Name: N-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethyl]-N'-methyl-2-nitro-acetamidine Formula: C13H22N4O3S MolecularWeight: 314.40378

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(C[N+](=O)[O-])NCCSCC1=CC=C(O1)CN(C)C

Isomeric SMILES

CN=C(C[N+](=O)[O-])NCCSCC1=CC=C(O1)CN(C)C

InChI

InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5H,6-10H2,1-3H3,(H,14,15)