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

Systemtic Name: 2-[2-[(4-methyl-3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanyl-(1,3-thiazol-4-yl)methyl]guanidine Openeye Name: 2-[2-[(4-methyl-3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanyl-thiazol-4-yl-methyl]guanidine CAS Name: 2-[[2-[(4-methyl-3-nitro-1H-pyrrol-2-yl)amino]ethylthio]-(4-thiazolyl)methyl]guanidine IUPAC Name: 2-[2-[(4-methyl-3-nitro-1H-pyrrol-2-yl)amino]ethylsulfanyl-(1,3-thiazol-4-yl)methyl]guanidine Traditional Name: 2-[[2-[(4-methyl-3-nitro-1H-pyrrol-2-yl)amino]ethylthio]-thiazol-4-yl-methyl]guanidine Formula: C12H17N7O2S2 MolecularWeight: 355.43908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC(=C1[N+](=O)[O-])NCCSC(C2=CSC=N2)N=C(N)N

Isomeric SMILES

CC1=CNC(=C1[N+](=O)[O-])NCCSC(C2=CSC=N2)N=C(N)N

InChI

InChI=1S/C12H17N7O2S2/c1-7-4-16-10(9(7)19(20)21)15-2-3-23-11(18-12(13)14)8-5-22-6-17-8/h4-6,11,15-16H,2-3H2,1H3,(H4,13,14,18)