2-(8-bromanyl-4-thiophen-3-yl-phthalazin-1-yl)guanidine dihydrochloride

Systemtic Name: 2-(8-bromanyl-4-thiophen-3-yl-phthalazin-1-yl)guanidine dihydrochloride Openeye Name: 2-[8-bromo-4-(3-thienyl)phthalazin-1-yl]guanidine dihydrochloride CAS Name: 2-[8-bromo-4-(3-thiophenyl)-1-phthalazinyl]guanidine dihydrochloride IUPAC Name: 2-(8-bromo-4-thiophen-3-ylphthalazin-1-yl)guanidine dihydrochloride Traditional Name: 2-[8-bromo-4-(3-thienyl)phthalazin-1-yl]guanidine dihydrochloride Formula: C13H12BrCl2N5S MolecularWeight: 421.14288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=NN=C2C3=CSC=C3)N=C(N)N.Cl.Cl

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=NN=C2C3=CSC=C3)N=C(N)N.Cl.Cl

InChI

InChI=1S/C13H10BrN5S.2ClH/c14-9-3-1-2-8-10(9)12(17-13(15)16)19-18-11(8)7-4-5-20-6-7;;/h1-6H,(H4,15,16,17,19);2*1H