1-[(4-methylphenyl)methyl]-5-[methyl(1-thiophen-2-ylethyl)amino]azepan-2-one

Systemtic Name: 1-[(4-methylphenyl)methyl]-5-[methyl(1-thiophen-2-ylethyl)amino]azepan-2-one Openeye Name: 5-[methyl-[1-(2-thienyl)ethyl]amino]-1-(p-tolylmethyl)azepan-2-one CAS Name: 1-[(4-methylphenyl)methyl]-5-[methyl(1-thiophen-2-ylethyl)amino]-2-azepanone IUPAC Name: 1-[(4-methylphenyl)methyl]-5-[methyl(1-thiophen-2-ylethyl)amino]azepan-2-one Traditional Name: 1-(4-methylbenzyl)-5-[methyl-[1-(2-thienyl)ethyl]amino]azepan-2-one Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(CCC2=O)N(C)C(C)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(CCC2=O)N(C)C(C)C3=CC=CS3

InChI

InChI=1S/C21H28N2OS/c1-16-6-8-18(9-7-16)15-23-13-12-19(10-11-21(23)24)22(3)17(2)20-5-4-14-25-20/h4-9,14,17,19H,10-13,15H2,1-3H3