[5-(carbamothioylamino)-2-chloranyl-phenyl]methyl-carboxy-carbamic acid

Systemtic Name: [5-(carbamothioylamino)-2-chloranyl-phenyl]methyl-carboxy-carbamic acid Openeye Name: [5-(carbamothioylamino)-2-chloro-phenyl]methyl-carboxy-carbamic acid CAS Name: [5-(carbamothioylamino)-2-chlorophenyl]methyl-carboxycarbamic acid IUPAC Name: [5-(carbamothioylamino)-2-chlorophenyl]methyl-carboxycarbamic acid Traditional Name: carboxy-(2-chloro-5-thioureido-benzyl)carbamic acid Formula: C10H10ClN3O4S MolecularWeight: 303.7221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=S)N)CN(C(=O)O)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=S)N)CN(C(=O)O)C(=O)O)Cl

InChI

InChI=1S/C10H10ClN3O4S/c11-7-2-1-6(13-8(12)19)3-5(7)4-14(9(15)16)10(17)18/h1-3H,4H2,(H,15,16)(H,17,18)(H3,12,13,19)