1-[(4-fluorophenyl)methyl]-5-[methyl(1,3-thiazol-4-ylmethyl)amino]azepan-2-one

Systemtic Name: 1-[(4-fluorophenyl)methyl]-5-[methyl(1,3-thiazol-4-ylmethyl)amino]azepan-2-one Openeye Name: 1-[(4-fluorophenyl)methyl]-5-[methyl(thiazol-4-ylmethyl)amino]azepan-2-one CAS Name: 1-[(4-fluorophenyl)methyl]-5-[methyl(4-thiazolylmethyl)amino]-2-azepanone IUPAC Name: 1-[(4-fluorophenyl)methyl]-5-[methyl(1,3-thiazol-4-ylmethyl)amino]azepan-2-one Traditional Name: 1-(4-fluorobenzyl)-5-[methyl(thiazol-4-ylmethyl)amino]azepan-2-one Formula: C18H22FN3OS MolecularWeight: 347.450183

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=N1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CN(CC1=CSC=N1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN3OS/c1-21(11-16-12-24-13-20-16)17-6-7-18(23)22(9-8-17)10-14-2-4-15(19)5-3-14/h2-5,12-13,17H,6-11H2,1H3