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methyl 3-(propan-2-ylcarbamothioylamino)benzoate

methyl 3-(propan-2-ylcarbamothioylamino)benzoate

Systemtic Name:methyl 3-(propan-2-ylcarbamothioylamino)benzoate
Openeye Name:methyl 3-(isopropylcarbamothioylamino)benzoate
CAS Name:3-[[(propan-2-ylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester
IUPAC Name:methyl 3-(propan-2-ylcarbamothioylamino)benzoate
Traditional Name:3-(isopropylthiocarbamoylamino)benzoic acid methyl ester
Formula: C12H16N2O2S
MolecularWeight: 252.33264
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=CC=CC(=C1)C(=O)OC


Isomeric SMILES

CC(C)NC(=S)NC1=CC=CC(=C1)C(=O)OC


InChI

InChI=1S/C12H16N2O2S/c1-8(2)13-12(17)14-10-6-4-5-9(7-10)11(15)16-3/h4-8H,1-3H3,(H2,13,14,17)


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