1-methyl-N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]pyrrole-2-carboxamide

Systemtic Name: 1-methyl-N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]pyrrole-2-carboxamide Openeye Name: 1-methyl-N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]pyrrole-2-carboxamide CAS Name: 1-methyl-N-[1-oxo-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]ethyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]pyrrole-2-carboxamide Traditional Name: 1-methyl-N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetyl]pyrrole-2-carboxamide Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)CSC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)CSC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H15N5O2S/c1-21-9-5-8-12(21)15(23)17-13(22)10-24-16-18-14(19-20-16)11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H,17,22,23)(H,18,19,20)