methyl 3-(piperidin-1-ylcarbothioylamino)benzoate

Systemtic Name: methyl 3-(piperidin-1-ylcarbothioylamino)benzoate Openeye Name: methyl 3-(piperidine-1-carbothioylamino)benzoate CAS Name: 3-[[1-piperidinyl(sulfanylidene)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-(piperidine-1-carbothioylamino)benzoate Traditional Name: 3-(piperidine-1-carbothioylamino)benzoic acid methyl ester Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=S)N2CCCCC2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=S)N2CCCCC2

InChI

InChI=1S/C14H18N2O2S/c1-18-13(17)11-6-5-7-12(10-11)15-14(19)16-8-3-2-4-9-16/h5-7,10H,2-4,8-9H2,1H3,(H,15,19)