N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2,4,6-trimethyl-benzamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2,4,6-trimethyl-benzamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2,4,6-trimethyl-benzamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-2,4,6-trimethylbenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-2,4,6-trimethylbenzamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2,4,6-trimethyl-benzamide Formula: C22H30N2OS MolecularWeight: 370.5514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)NCC(C2=CSC=C2)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)NCC(C2=CSC=C2)N3CCCCCC3)C

InChI

InChI=1S/C22H30N2OS/c1-16-12-17(2)21(18(3)13-16)22(25)23-14-20(19-8-11-26-15-19)24-9-6-4-5-7-10-24/h8,11-13,15,20H,4-7,9-10,14H2,1-3H3,(H,23,25)