[3,5-dimethyl-4-(phenylcarbamoylamino)phenyl] thiocyanate

Systemtic Name: [3,5-dimethyl-4-(phenylcarbamoylamino)phenyl] thiocyanate Openeye Name: [3,5-dimethyl-4-(phenylcarbamoylamino)phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[anilino(oxo)methyl]amino]-3,5-dimethylphenyl] ester IUPAC Name: [3,5-dimethyl-4-(phenylcarbamoylamino)phenyl] thiocyanate Traditional Name: thiocyanic acid [3,5-dimethyl-4-(phenylcarbamoylamino)phenyl] ester Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)NC2=CC=CC=C2)C)SC#N

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)NC2=CC=CC=C2)C)SC#N

InChI

InChI=1S/C16H15N3OS/c1-11-8-14(21-10-17)9-12(2)15(11)19-16(20)18-13-6-4-3-5-7-13/h3-9H,1-2H3,(H2,18,19,20)