4-[2-[[(1S,2S)-2-methylcyclohexyl]carbamothioyl]hydrazinyl]benzoic acid

Systemtic Name: 4-[2-[[(1S,2S)-2-methylcyclohexyl]carbamothioyl]hydrazinyl]benzoic acid Openeye Name: 4-[2-[[(1S,2S)-2-methylcyclohexyl]carbamothioyl]hydrazino]benzoic acid CAS Name: 4-[[[[(1S,2S)-2-methylcyclohexyl]amino]-sulfanylidenemethyl]hydrazo]benzoic acid IUPAC Name: 4-[2-[[(1S,2S)-2-methylcyclohexyl]carbamothioyl]hydrazinyl]benzoic acid Traditional Name: 4-[N'-[[(1S,2S)-2-methylcyclohexyl]thiocarbamoyl]hydrazino]benzoic acid Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H21N3O2S/c1-10-4-2-3-5-13(10)16-15(21)18-17-12-8-6-11(7-9-12)14(19)20/h6-10,13,17H,2-5H2,1H3,(H,19,20)(H2,16,18,21)/t10-,13-/m0/s1