methyl 2-[4-(3-methylbutylcarbamothioylamino)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(3-methylbutylcarbamothioylamino)phenyl]ethanoate Openeye Name: methyl 2-[4-(isopentylcarbamothioylamino)phenyl]acetate CAS Name: 2-[4-[[(3-methylbutylamino)-sulfanylidenemethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3-methylbutylcarbamothioylamino)phenyl]acetate Traditional Name: 2-[4-(isoamylthiocarbamoylamino)phenyl]acetic acid methyl ester Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2S/c1-11(2)8-9-16-15(20)17-13-6-4-12(5-7-13)10-14(18)19-3/h4-7,11H,8-10H2,1-3H3,(H2,16,17,20)