N-butyl-2-[4-(butylcarbamoyl)phenyl]-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophene-6-carboxamide

Systemtic Name: N-butyl-2-[4-(butylcarbamoyl)phenyl]-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophene-6-carboxamide Openeye Name: N-butyl-2-[4-(butylcarbamoyl)phenyl]-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophene-6-carboxamide CAS Name: N-butyl-2-[4-[butylamino(oxo)methyl]phenyl]-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophene-6-carboxamide IUPAC Name: N-butyl-2-[4-(butylcarbamoyl)phenyl]-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophene-6-carboxamide Traditional Name: N-butyl-2-[4-(butylcarbamoyl)phenyl]-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophene-6-carboxamide Formula: C38H45N3O4S MolecularWeight: 639.8466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)C(=O)NCCCC)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)C(=O)NCCCC)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C38H45N3O4S/c1-3-5-20-39-37(43)29-12-10-28(11-13-29)36-34(32-19-16-30(26-33(32)46-36)38(44)40-21-6-4-2)35(42)27-14-17-31(18-15-27)45-25-24-41-22-8-7-9-23-41/h10-19,26H,3-9,20-25H2,1-2H3,(H,39,43)(H,40,44)