methyl (NE)-N'-phenyl-N-[phenyl(phenylazanyl)methylidene]carbamimidothioate

Systemtic Name: methyl (NE)-N'-phenyl-N-[phenyl(phenylazanyl)methylidene]carbamimidothioate Openeye Name: (1E)-1-[anilino(phenyl)methylene]-2-methyl-3-phenyl-isothiourea CAS Name: (NE)-N-[anilino(phenyl)methylidene]-N'-phenylcarbamimidothioic acid methyl ester IUPAC Name: methyl (NE)-N-[anilino(phenyl)methylidene]-N'-phenylcarbamimidothioate Traditional Name: (1E)-1-[anilino(phenyl)methylene]-2-methyl-3-phenyl-isothiourea Formula: C21H19N3S MolecularWeight: 345.46066

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=CC=C1)N=C(C2=CC=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CSC(=NC1=CC=CC=C1)/N=C(\C2=CC=CC=C2)/NC3=CC=CC=C3

InChI

InChI=1S/C21H19N3S/c1-25-21(23-19-15-9-4-10-16-19)24-20(17-11-5-2-6-12-17)22-18-13-7-3-8-14-18/h2-16H,1H3,(H,22,23,24)