N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]benzothiophene-2-carboxamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]benzothiophene-2-carboxamide Formula: C16H15N5OS MolecularWeight: 325.3882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C(=O)NCCCC3=C(C(=NN3)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C(=O)NCCCC3=C(C(=NN3)N)C#N

InChI

InChI=1S/C16H15N5OS/c17-9-11-12(20-21-15(11)18)5-3-7-19-16(22)14-8-10-4-1-2-6-13(10)23-14/h1-2,4,6,8H,3,5,7H2,(H,19,22)(H3,18,20,21)