5-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-1-(cyclohexylmethyl)-2-methyl-pyrrole-3-carboxamide

Systemtic Name: 5-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-1-(cyclohexylmethyl)-2-methyl-pyrrole-3-carboxamide Openeye Name: 5-(5-chloro-3-methyl-benzothiophen-2-yl)-1-(cyclohexylmethyl)-2-methyl-pyrrole-3-carboxamide CAS Name: 5-(5-chloro-3-methyl-1-benzothiophen-2-yl)-1-(cyclohexylmethyl)-2-methyl-3-pyrrolecarboxamide IUPAC Name: 5-(5-chloro-3-methyl-1-benzothiophen-2-yl)-1-(cyclohexylmethyl)-2-methylpyrrole-3-carboxamide Traditional Name: 5-(5-chloro-3-methyl-benzothiophen-2-yl)-1-(cyclohexylmethyl)-2-methyl-pyrrole-3-carboxamide Formula: C22H25ClN2OS MolecularWeight: 400.9647

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)C3=CC(=C(N3CC4CCCCC4)C)C(=O)N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)C3=CC(=C(N3CC4CCCCC4)C)C(=O)N

InChI

InChI=1S/C22H25ClN2OS/c1-13-17-10-16(23)8-9-20(17)27-21(13)19-11-18(22(24)26)14(2)25(19)12-15-6-4-3-5-7-15/h8-11,15H,3-7,12H2,1-2H3,(H2,24,26)