S-[3-[2-methylprop-2-enyl(propanoyl)amino]phenyl] N-ethylcarbamothioate

Systemtic Name: S-[3-[2-methylprop-2-enyl(propanoyl)amino]phenyl] N-ethylcarbamothioate Openeye Name: S-[3-[2-methylallyl(propanoyl)amino]phenyl] N-ethylcarbamothioate CAS Name: N-ethylcarbamothioic acid S-[3-[2-methylprop-2-enyl(1-oxopropyl)amino]phenyl] ester IUPAC Name: S-[3-[2-methylprop-2-enyl(propanoyl)amino]phenyl] N-ethylcarbamothioate Traditional Name: N-ethylthiocarbamic acid S-[3-[2-methylallyl(propionyl)amino]phenyl] ester Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC(=C)C)C1=CC(=CC=C1)SC(=O)NCC

Isomeric SMILES

CCC(=O)N(CC(=C)C)C1=CC(=CC=C1)SC(=O)NCC

InChI

InChI=1S/C16H22N2O2S/c1-5-15(19)18(11-12(3)4)13-8-7-9-14(10-13)21-16(20)17-6-2/h7-10H,3,5-6,11H2,1-2,4H3,(H,17,20)