5-[cyclopropyl-[(1,3,5-trimethylpyrazol-4-yl)methyl]amino]-1-(3-methylbutyl)azepan-2-one

Systemtic Name: 5-[cyclopropyl-[(1,3,5-trimethylpyrazol-4-yl)methyl]amino]-1-(3-methylbutyl)azepan-2-one Openeye Name: 5-[cyclopropyl-[(1,3,5-trimethylpyrazol-4-yl)methyl]amino]-1-isopentyl-azepan-2-one CAS Name: 5-[cyclopropyl-[(1,3,5-trimethyl-4-pyrazolyl)methyl]amino]-1-(3-methylbutyl)-2-azepanone IUPAC Name: 5-[cyclopropyl-[(1,3,5-trimethylpyrazol-4-yl)methyl]amino]-1-(3-methylbutyl)azepan-2-one Traditional Name: 5-[cyclopropyl-[(1,3,5-trimethylpyrazol-4-yl)methyl]amino]-1-isoamyl-azepan-2-one Formula: C21H36N4O MolecularWeight: 360.53674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CN(C2CC2)C3CCC(=O)N(CC3)CCC(C)C

Isomeric SMILES

CC1=C(C(=NN1C)C)CN(C2CC2)C3CCC(=O)N(CC3)CCC(C)C

InChI

InChI=1S/C21H36N4O/c1-15(2)10-12-24-13-11-19(8-9-21(24)26)25(18-6-7-18)14-20-16(3)22-23(5)17(20)4/h15,18-19H,6-14H2,1-5H3