N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(3-pyridylmethyl)benzothiophene-2-carboxamide CAS Name: N-[(2,5-dimethyl-3-pyrazolyl)methyl]-N-(3-pyridinylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(3-pyridylmethyl)benzothiophene-2-carboxamide Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CN(CC2=CN=CC=C2)C(=O)C3=CC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=NN(C(=C1)CN(CC2=CN=CC=C2)C(=O)C3=CC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H20N4OS/c1-15-10-18(24(2)23-15)14-25(13-16-6-5-9-22-12-16)21(26)20-11-17-7-3-4-8-19(17)27-20/h3-12H,13-14H2,1-2H3