S-[[4-[2-(2-acetamido-1,3-thiazol-4-yl)ethyl]phenyl]methyl] N-azanylcarbamothioate

Systemtic Name: S-[[4-[2-(2-acetamido-1,3-thiazol-4-yl)ethyl]phenyl]methyl] N-azanylcarbamothioate Openeye Name: S-[[4-[2-(2-acetamidothiazol-4-yl)ethyl]phenyl]methyl] N-aminocarbamothioate CAS Name: N-aminocarbamothioic acid S-[[4-[2-(2-acetamido-4-thiazolyl)ethyl]phenyl]methyl] ester IUPAC Name: S-[[4-[2-(2-acetamido-1,3-thiazol-4-yl)ethyl]phenyl]methyl] N-aminocarbamothioate Traditional Name: N-aminothiocarbamic acid S-[4-[2-(2-acetamidothiazol-4-yl)ethyl]benzyl] ester Formula: C15H18N4O2S2 MolecularWeight: 350.45902

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)CCC2=CC=C(C=C2)CSC(=O)NN

Isomeric SMILES

CC(=O)NC1=NC(=CS1)CCC2=CC=C(C=C2)CSC(=O)NN

InChI

InChI=1S/C15H18N4O2S2/c1-10(20)17-14-18-13(9-22-14)7-6-11-2-4-12(5-3-11)8-23-15(21)19-16/h2-5,9H,6-8,16H2,1H3,(H,19,21)(H,17,18,20)