[3-(carbamothioylamino)-4-chloranyl-phenyl]methylcarbamic acid

Systemtic Name: [3-(carbamothioylamino)-4-chloranyl-phenyl]methylcarbamic acid Openeye Name: [3-(carbamothioylamino)-4-chloro-phenyl]methylcarbamic acid CAS Name: [3-(carbamothioylamino)-4-chlorophenyl]methylcarbamic acid IUPAC Name: [3-(carbamothioylamino)-4-chlorophenyl]methylcarbamic acid Traditional Name: (4-chloro-3-thioureido-benzyl)carbamic acid Formula: C9H10ClN3O2S MolecularWeight: 259.7126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC(=O)O)NC(=S)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1CNC(=O)O)NC(=S)N)Cl

InChI

InChI=1S/C9H10ClN3O2S/c10-6-2-1-5(4-12-9(14)15)3-7(6)13-8(11)16/h1-3,12H,4H2,(H,14,15)(H3,11,13,16)