3-phenyl-N-prop-2-ynyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: 3-phenyl-N-prop-2-ynyl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: 3-phenyl-N-prop-2-ynyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: 3-phenyl-N-prop-2-ynyl-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: 3-phenyl-N-prop-2-ynyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: 3-phenyl-N-propargyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C13H11N3OS MolecularWeight: 257.31094

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C1=CNC(=S)N1C2=CC=CC=C2

Isomeric SMILES

C#CCNC(=O)C1=CNC(=S)N1C2=CC=CC=C2

InChI

InChI=1S/C13H11N3OS/c1-2-8-14-12(17)11-9-15-13(18)16(11)10-6-4-3-5-7-10/h1,3-7,9H,8H2,(H,14,17)(H,15,18)