O-[3-[(phenylcarbamothioylamino)carbamoyl]phenyl] N-phenylcarbamothioate

Systemtic Name: O-[3-[(phenylcarbamothioylamino)carbamoyl]phenyl] N-phenylcarbamothioate Openeye Name: O-[3-[(phenylcarbamothioylamino)carbamoyl]phenyl] N-phenylcarbamothioate CAS Name: N-phenylcarbamothioic acid O-[3-[[[anilino(sulfanylidene)methyl]hydrazo]-oxomethyl]phenyl] ester IUPAC Name: O-[3-[(phenylcarbamothioylamino)carbamoyl]phenyl] N-phenylcarbamothioate Traditional Name: N-phenylthiocarbamic acid O-[3-[(phenylthiocarbamoylamino)carbamoyl]phenyl] ester Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CC=C2)OC(=S)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CC=C2)OC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C21H18N4O2S2/c26-19(24-25-20(28)22-16-9-3-1-4-10-16)15-8-7-13-18(14-15)27-21(29)23-17-11-5-2-6-12-17/h1-14H,(H,23,29)(H,24,26)(H2,22,25,28)