1-[(4-methoxyphenyl)methyl]-5-[methyl(thiophen-3-ylmethyl)amino]azepan-2-one

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-5-[methyl(thiophen-3-ylmethyl)amino]azepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-5-[methyl(3-thienylmethyl)amino]azepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-5-[methyl(3-thiophenylmethyl)amino]-2-azepanone IUPAC Name: 1-[(4-methoxyphenyl)methyl]-5-[methyl(thiophen-3-ylmethyl)amino]azepan-2-one Traditional Name: 5-[methyl(3-thenyl)amino]-1-p-anisyl-azepan-2-one Formula: C20H26N2O2S MolecularWeight: 358.49764

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CN(CC1=CSC=C1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H26N2O2S/c1-21(13-17-10-12-25-15-17)18-5-8-20(23)22(11-9-18)14-16-3-6-19(24-2)7-4-16/h3-4,6-7,10,12,15,18H,5,8-9,11,13-14H2,1-2H3