methyl 3-(ethylcarbamothioylamino)-4-methyl-benzoate

Systemtic Name: methyl 3-(ethylcarbamothioylamino)-4-methyl-benzoate Openeye Name: methyl 3-(ethylcarbamothioylamino)-4-methyl-benzoate CAS Name: 3-[[ethylamino(sulfanylidene)methyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-(ethylcarbamothioylamino)-4-methylbenzoate Traditional Name: 3-(ethylthiocarbamoylamino)-4-methyl-benzoic acid methyl ester Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O2S/c1-4-13-12(17)14-10-7-9(11(15)16-3)6-5-8(10)2/h5-7H,4H2,1-3H3,(H2,13,14,17)