2-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propanoylamino]thiophene-3-carboxamide Formula: C16H15N5O2S2 MolecularWeight: 373.4526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)SC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C(=O)N)SC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H15N5O2S2/c1-9(14(23)19-15-11(12(17)22)7-8-24-15)25-16-18-13(20-21-16)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,22)(H,19,23)(H,18,20,21)