N-(4-azanylcyclohexyl)-3-chloranyl-N-[[4-(4-cyanophenyl)phenyl]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-chloranyl-N-[[4-(4-cyanophenyl)phenyl]methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-3-chloro-N-[[4-(4-cyanophenyl)phenyl]methyl]benzothiophene-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-3-chloro-N-[[4-(4-cyanophenyl)phenyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-3-chloro-N-[[4-(4-cyanophenyl)phenyl]methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-3-chloro-N-[4-(4-cyanophenyl)benzyl]benzothiophene-2-carboxamide Formula: C29H26ClN3OS MolecularWeight: 500.05424

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)C(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)C(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C29H26ClN3OS/c30-27-25-3-1-2-4-26(25)35-28(27)29(34)33(24-15-13-23(32)14-16-24)18-20-7-11-22(12-8-20)21-9-5-19(17-31)6-10-21/h1-12,23-24H,13-16,18,32H2