[2-oxidanylidene-2-(4-phenylphenyl)ethyl] N-cyano-N'-methyl-carbamimidothioate

Systemtic Name: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] N-cyano-N'-methyl-carbamimidothioate Openeye Name: 1-cyano-3-methyl-2-[2-oxo-2-(4-phenylphenyl)ethyl]isothiourea CAS Name: N-cyano-N'-methylcarbamimidothioic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] N-cyano-N'-methylcarbamimidothioate Traditional Name: 1-cyano-2-[2-keto-2-(4-phenylphenyl)ethyl]-3-methyl-isothiourea Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NC#N)SCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CN=C(NC#N)SCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C17H15N3OS/c1-19-17(20-12-18)22-11-16(21)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,20)