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

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-[(4-chlorophenyl)sulfanylmethyl]benzofuran-2-carboxamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-[[(4-chlorophenyl)thio]methyl]-2-benzofurancarboxamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-[[(4-chlorophenyl)thio]methyl]coumarilamide Formula: C23H20ClN5O2S MolecularWeight: 465.9552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)C(=O)NCCCC3=C(C(=NN3)N)C#N)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)C(=O)NCCCC3=C(C(=NN3)N)C#N)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H20ClN5O2S/c24-14-7-9-15(10-8-14)32-13-18-16-4-1-2-6-20(16)31-21(18)23(30)27-11-3-5-19-17(12-25)22(26)29-28-19/h1-2,4,6-10H,3,5,11,13H2,(H,27,30)(H3,26,28,29)