N-(phenylmethyl)-6-sulfanylidene-1H-pyrimidine-5-carboxamide

Systemtic Name: N-(phenylmethyl)-6-sulfanylidene-1H-pyrimidine-5-carboxamide Openeye Name: N-benzyl-6-thioxo-1H-pyrimidine-5-carboxamide CAS Name: N-(phenylmethyl)-6-sulfanylidene-1H-pyrimidine-5-carboxamide IUPAC Name: N-benzyl-6-sulfanylidene-1H-pyrimidine-5-carboxamide Traditional Name: N-benzyl-6-thioxo-1H-pyrimidine-5-carboxamide Formula: C12H11N3OS MolecularWeight: 245.30024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CN=CNC2=S

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CN=CNC2=S

InChI

InChI=1S/C12H11N3OS/c16-11(10-7-13-8-15-12(10)17)14-6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H,14,16)(H,13,15,17)