N-[2-[[5-(2-azanylpropan-2-yl)furan-2-yl]methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine

Systemtic Name: N-[2-[[5-(2-azanylpropan-2-yl)furan-2-yl]methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine Openeye Name: N-[2-[[5-(1-amino-1-methyl-ethyl)-2-furyl]methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine CAS Name: N-[2-[[5-(2-aminopropan-2-yl)-2-furanyl]methylthio]ethyl]-3-nitro-1H-pyrrol-2-amine IUPAC Name: N-[2-[[5-(2-aminopropan-2-yl)furan-2-yl]methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine Traditional Name: 2-[[5-(1-amino-1-methyl-ethyl)-2-furyl]methylthio]ethyl-(3-nitro-1H-pyrrol-2-yl)amine Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(O1)CSCCNC2=C(C=CN2)[N+](=O)[O-])N

Isomeric SMILES

CC(C)(C1=CC=C(O1)CSCCNC2=C(C=CN2)[N+](=O)[O-])N

InChI

InChI=1S/C14H20N4O3S/c1-14(2,15)12-4-3-10(21-12)9-22-8-7-17-13-11(18(19)20)5-6-16-13/h3-6,16-17H,7-9,15H2,1-2H3