N-(2-aminophenyl)-6-[(4-phenyl-1,2,3-triazol-1-yl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[(4-phenyl-1,2,3-triazol-1-yl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[(4-phenyltriazol-1-yl)methyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[(4-phenyl-1-triazolyl)methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[(4-phenyltriazol-1-yl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[(4-phenyltriazol-1-yl)methyl]benzothiophene-2-carboxamide Formula: C24H19N5OS MolecularWeight: 425.50556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(N=N2)CC3=CC4=C(C=C3)C=C(S4)C(=O)NC5=CC=CC=C5N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(N=N2)CC3=CC4=C(C=C3)C=C(S4)C(=O)NC5=CC=CC=C5N

InChI

InChI=1S/C24H19N5OS/c25-19-8-4-5-9-20(19)26-24(30)23-13-18-11-10-16(12-22(18)31-23)14-29-15-21(27-28-29)17-6-2-1-3-7-17/h1-13,15H,14,25H2,(H,26,30)