N-[2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-3,5,6-trimethyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-3,5,6-trimethyl-1-benzofuran-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(2-thienyl)ethyl]-3,5,6-trimethyl-benzofuran-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-thiophen-2-ylethyl]-3,5,6-trimethyl-2-benzofurancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-2-ylethyl]-3,5,6-trimethyl-1-benzofuran-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(2-thienyl)ethyl]-3,5,6-trimethyl-coumarilamide Formula: C24H30N2O2S MolecularWeight: 410.5722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(O2)C(=O)NCC(C3=CC=CS3)N4CCCCCC4)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(O2)C(=O)NCC(C3=CC=CS3)N4CCCCCC4)C)C

InChI

InChI=1S/C24H30N2O2S/c1-16-13-19-18(3)23(28-21(19)14-17(16)2)24(27)25-15-20(22-9-8-12-29-22)26-10-6-4-5-7-11-26/h8-9,12-14,20H,4-7,10-11,15H2,1-3H3,(H,25,27)