2-[4-(carbamothioylamino)-2-chloranyl-phenyl]ethylcarbamic acid

Systemtic Name: 2-[4-(carbamothioylamino)-2-chloranyl-phenyl]ethylcarbamic acid Openeye Name: 2-[4-(carbamothioylamino)-2-chloro-phenyl]ethylcarbamic acid CAS Name: 2-[4-(carbamothioylamino)-2-chlorophenyl]ethylcarbamic acid IUPAC Name: 2-[4-(carbamothioylamino)-2-chlorophenyl]ethylcarbamic acid Traditional Name: 2-(2-chloro-4-thioureido-phenyl)ethylcarbamic acid Formula: C10H12ClN3O2S MolecularWeight: 273.73918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12ClN3O2S/c11-8-5-7(14-9(12)17)2-1-6(8)3-4-13-10(15)16/h1-2,5,13H,3-4H2,(H,15,16)(H3,12,14,17)