N-[2-(azepan-1-yl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-4-[(2-methylthiazol-4-yl)methylsulfanyl]benzamide CAS Name: N-[2-(1-azepanyl)ethyl]-4-[(2-methyl-4-thiazolyl)methylthio]benzamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-4-[(2-methylthiazol-4-yl)methylthio]benzamide Formula: C20H27N3OS2 MolecularWeight: 389.57788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NCCN3CCCCCC3

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NCCN3CCCCCC3

InChI

InChI=1S/C20H27N3OS2/c1-16-22-18(14-25-16)15-26-19-8-6-17(7-9-19)20(24)21-10-13-23-11-4-2-3-5-12-23/h6-9,14H,2-5,10-13,15H2,1H3,(H,21,24)