N-(2,6-diethylphenyl)-2-[4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[4-[(3-methyl-2-thienyl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-(2,6-diethylphenyl)-2-[4-[(3-methyl-2-thiophenyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-(2,6-diethylphenyl)-2-[4-[(3-methyl-2-thienyl)methyl]-1,4-diazepan-1-yl]acetamide Formula: C23H33N3OS MolecularWeight: 399.59262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)CC3=C(C=CS3)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)CC3=C(C=CS3)C

InChI

InChI=1S/C23H33N3OS/c1-4-19-8-6-9-20(5-2)23(19)24-22(27)17-26-12-7-11-25(13-14-26)16-21-18(3)10-15-28-21/h6,8-10,15H,4-5,7,11-14,16-17H2,1-3H3,(H,24,27)