methyl 2-[4-(cyclopropylcarbamothioylamino)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(cyclopropylcarbamothioylamino)phenyl]ethanoate Openeye Name: methyl 2-[4-(cyclopropylcarbamothioylamino)phenyl]acetate CAS Name: 2-[4-[[(cyclopropylamino)-sulfanylidenemethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(cyclopropylcarbamothioylamino)phenyl]acetate Traditional Name: 2-[4-(cyclopropylthiocarbamoylamino)phenyl]acetic acid methyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)NC(=S)NC2CC2

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)NC(=S)NC2CC2

InChI

InChI=1S/C13H16N2O2S/c1-17-12(16)8-9-2-4-10(5-3-9)14-13(18)15-11-6-7-11/h2-5,11H,6-8H2,1H3,(H2,14,15,18)