O-[4-[(4-bromophenyl)carbamoyl]phenyl] N-(4-nitrophenyl)carbamothioate

Systemtic Name: O-[4-[(4-bromophenyl)carbamoyl]phenyl] N-(4-nitrophenyl)carbamothioate Openeye Name: O-[4-[(4-bromophenyl)carbamoyl]phenyl] N-(4-nitrophenyl)carbamothioate CAS Name: N-(4-nitrophenyl)carbamothioic acid O-[4-[(4-bromoanilino)-oxomethyl]phenyl] ester IUPAC Name: O-[4-[(4-bromophenyl)carbamoyl]phenyl] N-(4-nitrophenyl)carbamothioate Traditional Name: N-(4-nitrophenyl)thiocarbamic acid O-[4-[(4-bromophenyl)carbamoyl]phenyl] ester Formula: C20H14BrN3O4S MolecularWeight: 472.31186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)Br)OC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)Br)OC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H14BrN3O4S/c21-14-3-5-15(6-4-14)22-19(25)13-1-11-18(12-2-13)28-20(29)23-16-7-9-17(10-8-16)24(26)27/h1-12H,(H,22,25)(H,23,29)