[3-(carbamothioylamino)phenyl]methyl-carboxy-carbamic acid

Systemtic Name: [3-(carbamothioylamino)phenyl]methyl-carboxy-carbamic acid Openeye Name: [3-(carbamothioylamino)phenyl]methyl-carboxy-carbamic acid CAS Name: [3-(carbamothioylamino)phenyl]methyl-carboxycarbamic acid IUPAC Name: [3-(carbamothioylamino)phenyl]methyl-carboxycarbamic acid Traditional Name: carboxy-(3-thioureidobenzyl)carbamic acid Formula: C10H11N3O4S MolecularWeight: 269.27704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)N)CN(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)N)CN(C(=O)O)C(=O)O

InChI

InChI=1S/C10H11N3O4S/c11-8(18)12-7-3-1-2-6(4-7)5-13(9(14)15)10(16)17/h1-4H,5H2,(H,14,15)(H,16,17)(H3,11,12,18)