S-[2-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl] N-butylcarbamothioate

Systemtic Name: S-[2-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl] N-butylcarbamothioate Openeye Name: S-[2-[[(1R)-2-amino-1-methyl-2-oxo-ethyl]carbamoyl]phenyl] N-butylcarbamothioate CAS Name: N-butylcarbamothioic acid S-[2-[[[(2R)-1-amino-1-oxopropan-2-yl]amino]-oxomethyl]phenyl] ester IUPAC Name: S-[2-[[(2R)-1-amino-1-oxopropan-2-yl]carbamoyl]phenyl] N-butylcarbamothioate Traditional Name: N-butylthiocarbamic acid S-[2-[[(1R)-2-amino-2-keto-1-methyl-ethyl]carbamoyl]phenyl] ester Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCNC(=O)SC1=CC=CC=C1C(=O)N[C@H](C)C(=O)N

InChI

InChI=1S/C15H21N3O3S/c1-3-4-9-17-15(21)22-12-8-6-5-7-11(12)14(20)18-10(2)13(16)19/h5-8,10H,3-4,9H2,1-2H3,(H2,16,19)(H,17,21)(H,18,20)/t10-/m1/s1