2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanyl-(1,3-thiazol-4-yl)methyl]guanidine

Systemtic Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanyl-(1,3-thiazol-4-yl)methyl]guanidine Openeye Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanyl-thiazol-4-yl-methyl]guanidine CAS Name: 2-[[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylthio]-(4-thiazolyl)methyl]guanidine IUPAC Name: 2-[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanyl-(1,3-thiazol-4-yl)methyl]guanidine Traditional Name: 2-[[2-[(3-nitro-1H-pyrrol-2-yl)amino]ethylthio]-thiazol-4-yl-methyl]guanidine Formula: C11H15N7O2S2 MolecularWeight: 341.4125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1[N+](=O)[O-])NCCSC(C2=CSC=N2)N=C(N)N

Isomeric SMILES

C1=CNC(=C1[N+](=O)[O-])NCCSC(C2=CSC=N2)N=C(N)N

InChI

InChI=1S/C11H15N7O2S2/c12-11(13)17-10(7-5-21-6-16-7)22-4-3-15-9-8(18(19)20)1-2-14-9/h1-2,5-6,10,14-15H,3-4H2,(H4,12,13,17)