N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-[(4-methylthiazol-2-yl)sulfanylmethyl]benzofuran-2-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-3-[[(4-methyl-2-thiazolyl)thio]methyl]-2-benzofurancarboxamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-[[(4-methylthiazol-2-yl)thio]methyl]coumarilamide Formula: C22H24N4O2S2 MolecularWeight: 440.58156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC(=CS4)C)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC(=CS4)C)C

InChI

InChI=1S/C22H24N4O2S2/c1-14-11-16(3)26(25-14)10-6-9-23-21(27)20-18(13-30-22-24-15(2)12-29-22)17-7-4-5-8-19(17)28-20/h4-5,7-8,11-12H,6,9-10,13H2,1-3H3,(H,23,27)