[4-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]amino]phenyl] thiocyanate

Systemtic Name: [4-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]amino]phenyl] thiocyanate Openeye Name: [4-[[2-(benzylamino)-2-oxo-ethyl]amino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[2-oxo-2-[(phenylmethyl)amino]ethyl]amino]phenyl] ester IUPAC Name: [4-[[2-(benzylamino)-2-oxoethyl]amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[[2-(benzylamino)-2-keto-ethyl]amino]phenyl] ester Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CNC2=CC=C(C=C2)SC#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CNC2=CC=C(C=C2)SC#N

InChI

InChI=1S/C16H15N3OS/c17-12-21-15-8-6-14(7-9-15)18-11-16(20)19-10-13-4-2-1-3-5-13/h1-9,18H,10-11H2,(H,19,20)