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

Systemtic Name: 5-[methyl-[(4-methyl-1,3-thiazol-2-yl)methyl]amino]-1-(4-methylpentyl)azepan-2-one Openeye Name: 1-isohexyl-5-[methyl-[(4-methylthiazol-2-yl)methyl]amino]azepan-2-one CAS Name: 5-[methyl-[(4-methyl-2-thiazolyl)methyl]amino]-1-(4-methylpentyl)-2-azepanone IUPAC Name: 5-[methyl-[(4-methyl-1,3-thiazol-2-yl)methyl]amino]-1-(4-methylpentyl)azepan-2-one Traditional Name: 1-isohexyl-5-[methyl-[(4-methylthiazol-2-yl)methyl]amino]azepan-2-one Formula: C18H31N3OS MolecularWeight: 337.52324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)CN(C)C2CCC(=O)N(CC2)CCCC(C)C

Isomeric SMILES

CC1=CSC(=N1)CN(C)C2CCC(=O)N(CC2)CCCC(C)C

InChI

InChI=1S/C18H31N3OS/c1-14(2)6-5-10-21-11-9-16(7-8-18(21)22)20(4)12-17-19-15(3)13-23-17/h13-14,16H,5-12H2,1-4H3