2-(5-carbamothioyl-1H-indol-3-yl)ethylcarbamic acid

Systemtic Name: 2-(5-carbamothioyl-1H-indol-3-yl)ethylcarbamic acid Openeye Name: 2-(5-carbamothioyl-1H-indol-3-yl)ethylcarbamic acid CAS Name: 2-(5-carbamothioyl-1H-indol-3-yl)ethylcarbamic acid IUPAC Name: 2-(5-carbamothioyl-1H-indol-3-yl)ethylcarbamic acid Traditional Name: 2-(5-thiocarbamoyl-1H-indol-3-yl)ethylcarbamic acid Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=S)N)C(=CN2)CCNC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(=S)N)C(=CN2)CCNC(=O)O

InChI

InChI=1S/C12H13N3O2S/c13-11(18)7-1-2-10-9(5-7)8(6-15-10)3-4-14-12(16)17/h1-2,5-6,14-15H,3-4H2,(H2,13,18)(H,16,17)