S-[2-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl] N-(3-chloranylpropyl)carbamothioate

Systemtic Name: S-[2-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl] N-(3-chloranylpropyl)carbamothioate Openeye Name: S-[2-[[(1R)-2-amino-1-methyl-2-oxo-ethyl]carbamoyl]phenyl] N-(3-chloropropyl)carbamothioate CAS Name: N-(3-chloropropyl)carbamothioic 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-(3-chloropropyl)carbamothioate Traditional Name: N-(3-chloropropyl)thiocarbamic acid S-[2-[[(1R)-2-amino-2-keto-1-methyl-ethyl]carbamoyl]phenyl] ester Formula: C14H18ClN3O3S MolecularWeight: 343.82902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)NC(=O)C1=CC=CC=C1SC(=O)NCCCCl

Isomeric SMILES

C[C@H](C(=O)N)NC(=O)C1=CC=CC=C1SC(=O)NCCCCl

InChI

InChI=1S/C14H18ClN3O3S/c1-9(12(16)19)18-13(20)10-5-2-3-6-11(10)22-14(21)17-8-4-7-15/h2-3,5-6,9H,4,7-8H2,1H3,(H2,16,19)(H,17,21)(H,18,20)/t9-/m1/s1