S-(4-nitrophenyl) N-[2,3-bis(bromanyl)propyl]carbamothioate

Systemtic Name: S-(4-nitrophenyl) N-[2,3-bis(bromanyl)propyl]carbamothioate Openeye Name: S-(4-nitrophenyl) N-(2,3-dibromopropyl)carbamothioate CAS Name: N-(2,3-dibromopropyl)carbamothioic acid S-(4-nitrophenyl) ester IUPAC Name: S-(4-nitrophenyl) N-(2,3-dibromopropyl)carbamothioate Traditional Name: N-(2,3-dibromopropyl)thiocarbamic acid S-(4-nitrophenyl) ester Formula: C10H10Br2N2O3S MolecularWeight: 398.071

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SC(=O)NCC(CBr)Br

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SC(=O)NCC(CBr)Br

InChI

InChI=1S/C10H10Br2N2O3S/c11-5-7(12)6-13-10(15)18-9-3-1-8(2-4-9)14(16)17/h1-4,7H,5-6H2,(H,13,15)