S-[2-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl] N-tert-butylcarbamothioate

Systemtic Name: S-[2-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl] N-tert-butylcarbamothioate Openeye Name: S-[2-[(2-amino-2-oxo-ethyl)carbamoyl]phenyl] N-tert-butylcarbamothioate CAS Name: N-tert-butylcarbamothioic acid S-[2-[[(2-amino-2-oxoethyl)amino]-oxomethyl]phenyl] ester IUPAC Name: S-[2-[(2-amino-2-oxoethyl)carbamoyl]phenyl] N-tert-butylcarbamothioate Traditional Name: N-tert-butylthiocarbamic acid S-[2-[(2-amino-2-keto-ethyl)carbamoyl]phenyl] ester Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)SC1=CC=CC=C1C(=O)NCC(=O)N

Isomeric SMILES

CC(C)(C)NC(=O)SC1=CC=CC=C1C(=O)NCC(=O)N

InChI

InChI=1S/C14H19N3O3S/c1-14(2,3)17-13(20)21-10-7-5-4-6-9(10)12(19)16-8-11(15)18/h4-7H,8H2,1-3H3,(H2,15,18)(H,16,19)(H,17,20)