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

Systemtic Name: N-phenyl-2-[4-(phenylcarbamoyl)phenyl]-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophene-6-carboxamide Openeye Name: N-phenyl-2-[4-(phenylcarbamoyl)phenyl]-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophene-6-carboxamide CAS Name: 2-[4-[anilino(oxo)methyl]phenyl]-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-N-phenyl-1-benzothiophene-6-carboxamide IUPAC Name: N-phenyl-2-[4-(phenylcarbamoyl)phenyl]-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophene-6-carboxamide Traditional Name: N-phenyl-2-[4-(phenylcarbamoyl)phenyl]-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophene-6-carboxamide Formula: C42H37N3O4S MolecularWeight: 679.82588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)C(=O)NC5=CC=CC=C5)C6=CC=C(C=C6)C(=O)NC7=CC=CC=C7

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)C(=O)NC5=CC=CC=C5)C6=CC=C(C=C6)C(=O)NC7=CC=CC=C7

InChI

InChI=1S/C42H37N3O4S/c46-39(29-18-21-35(22-19-29)49-27-26-45-24-8-3-9-25-45)38-36-23-20-32(42(48)44-34-12-6-2-7-13-34)28-37(36)50-40(38)30-14-16-31(17-15-30)41(47)43-33-10-4-1-5-11-33/h1-2,4-7,10-23,28H,3,8-9,24-27H2,(H,43,47)(H,44,48)