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4-[(methylcarbamothioylamino)methyl]benzoic acid

4-[(methylcarbamothioylamino)methyl]benzoic acid

Systemtic Name:4-[(methylcarbamothioylamino)methyl]benzoic acid
Openeye Name:4-[(methylcarbamothioylamino)methyl]benzoic acid
CAS Name:4-[[[methylamino(sulfanylidene)methyl]amino]methyl]benzoic acid
IUPAC Name:4-[(methylcarbamothioylamino)methyl]benzoic acid
Traditional Name:4-[(methylthiocarbamoylamino)methyl]benzoic acid
Formula: C10H12N2O2S
MolecularWeight: 224.27948
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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCC1=CC=C(C=C1)C(=O)O


Isomeric SMILES

CNC(=S)NCC1=CC=C(C=C1)C(=O)O


InChI

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


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