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methyl 4-(carbamimidoylsulfanylmethyl)benzoate hydrobromide

methyl 4-(carbamimidoylsulfanylmethyl)benzoate hydrobromide

Systemtic Name:methyl 4-(carbamimidoylsulfanylmethyl)benzoate hydrobromide
Openeye Name:methyl 4-(carbamimidoylsulfanylmethyl)benzoate hydrobromide
CAS Name:4-[(carbamimidoylthio)methyl]benzoic acid methyl ester hydrobromide
IUPAC Name:methyl 4-(carbamimidoylsulfanylmethyl)benzoate hydrobromide
Traditional Name:4-[(amidinothio)methyl]benzoic acid methyl ester hydrobromide
Formula: C10H13BrN2O2S
MolecularWeight: 305.19142
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC(=N)N.Br


Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC(=N)N.Br


InChI

InChI=1S/C10H12N2O2S.BrH/c1-14-9(13)8-4-2-7(3-5-8)6-15-10(11)12;/h2-5H,6H2,1H3,(H3,11,12);1H


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