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

Systemtic Name: 5-acetamido-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide Openeye Name: 5-acetamido-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide CAS Name: 5-acetamido-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-acetamido-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide Traditional Name: 5-acetamido-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]thiophene-2-carboxamide Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(S1)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC(=O)NC1=CC=C(S1)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C17H17N5O2S/c1-12(23)21-16-7-6-15(25-16)17(24)19-8-13-2-4-14(5-3-13)9-22-11-18-10-20-22/h2-7,10-11H,8-9H2,1H3,(H,19,24)(H,21,23)