[4-[(4-phenoxyphenyl)carbamothioylamino]phenyl] thiocyanate

Systemtic Name: [4-[(4-phenoxyphenyl)carbamothioylamino]phenyl] thiocyanate Openeye Name: [4-[(4-phenoxyphenyl)carbamothioylamino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[(4-phenoxyanilino)-sulfanylidenemethyl]amino]phenyl] ester IUPAC Name: [4-[(4-phenoxyphenyl)carbamothioylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(4-phenoxyphenyl)thiocarbamoylamino]phenyl] ester Formula: C20H15N3OS2 MolecularWeight: 377.4826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)SC#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)SC#N

InChI

InChI=1S/C20H15N3OS2/c21-14-26-19-12-8-16(9-13-19)23-20(25)22-15-6-10-18(11-7-15)24-17-4-2-1-3-5-17/h1-13H,(H2,22,23,25)