azepan-1-yl-[2-[3,5-dimethyl-4-(phenylmethyl)pyrazol-1-yl]-4-methyl-1,3-thiazol-5-yl]methanone

Systemtic Name: azepan-1-yl-[2-[3,5-dimethyl-4-(phenylmethyl)pyrazol-1-yl]-4-methyl-1,3-thiazol-5-yl]methanone Openeye Name: azepan-1-yl-[2-(4-benzyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-thiazol-5-yl]methanone CAS Name: 1-azepanyl-[2-[3,5-dimethyl-4-(phenylmethyl)-1-pyrazolyl]-4-methyl-5-thiazolyl]methanone IUPAC Name: azepan-1-yl-[2-(4-benzyl-3,5-dimethylpyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl]methanone Traditional Name: azepan-1-yl-[2-(4-benzyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-thiazol-5-yl]methanone Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(=C(C(=N2)C)CC3=CC=CC=C3)C)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(SC(=N1)N2C(=C(C(=N2)C)CC3=CC=CC=C3)C)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H28N4OS/c1-16-20(15-19-11-7-6-8-12-19)18(3)27(25-16)23-24-17(2)21(29-23)22(28)26-13-9-4-5-10-14-26/h6-8,11-12H,4-5,9-10,13-15H2,1-3H3