5-(1,3-benzothiazol-2-yl)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]thiophene-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]thiophene-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]thiophene-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]thiophene-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]thiophene-2-carboxamide Formula: C21H15N5OS2 MolecularWeight: 417.5067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(S3)C(=O)NCC4=C(N=CC=C4)N5C=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(S3)C(=O)NCC4=C(N=CC=C4)N5C=CC=N5

InChI

InChI=1S/C21H15N5OS2/c27-20(23-13-14-5-3-10-22-19(14)26-12-4-11-24-26)17-8-9-18(28-17)21-25-15-6-1-2-7-16(15)29-21/h1-12H,13H2,(H,23,27)