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

Systemtic Name: methyl 2-[4-(propylcarbamothioylamino)phenyl]ethanoate Openeye Name: methyl 2-[4-(propylcarbamothioylamino)phenyl]acetate CAS Name: 2-[4-[[propylamino(sulfanylidene)methyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(propylcarbamothioylamino)phenyl]acetate Traditional Name: 2-[4-(propylthiocarbamoylamino)phenyl]acetic acid methyl ester Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O2S/c1-3-8-14-13(18)15-11-6-4-10(5-7-11)9-12(16)17-2/h4-7H,3,8-9H2,1-2H3,(H2,14,15,18)