5-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: 5-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]thiophene-2-carboxamide Openeye Name: 5-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]thiophene-2-carboxamide CAS Name: 5-methyl-N-[4-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: 5-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]thiophene-2-carboxamide Traditional Name: 5-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]thiophene-2-carboxamide Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC2=CC=C(C=C2)NC(=O)C(C)N3C=NC=N3

Isomeric SMILES

CC1=CC=C(S1)C(=O)NC2=CC=C(C=C2)NC(=O)C(C)N3C=NC=N3

InChI

InChI=1S/C17H17N5O2S/c1-11-3-8-15(25-11)17(24)21-14-6-4-13(5-7-14)20-16(23)12(2)22-10-18-9-19-22/h3-10,12H,1-2H3,(H,20,23)(H,21,24)