N-[(4-pyrimidin-2-ylsulfanylphenyl)carbamothioyl]benzamide

Systemtic Name: N-[(4-pyrimidin-2-ylsulfanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-pyrimidin-2-ylsulfanylphenyl)carbamothioyl]benzamide CAS Name: N-[[4-(2-pyrimidinylthio)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(4-pyrimidin-2-ylsulfanylphenyl)carbamothioyl]benzamide Traditional Name: N-[[4-(2-pyrimidylthio)phenyl]thiocarbamoyl]benzamide Formula: C18H14N4OS2 MolecularWeight: 366.45996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)SC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)SC3=NC=CC=N3

InChI

InChI=1S/C18H14N4OS2/c23-16(13-5-2-1-3-6-13)22-17(24)21-14-7-9-15(10-8-14)25-18-19-11-4-12-20-18/h1-12H,(H2,21,22,23,24)