ethyl 7-[4-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]phenoxy]-2,2-dimethyl-heptanoate

Systemtic Name: ethyl 7-[4-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]phenoxy]-2,2-dimethyl-heptanoate Openeye Name: ethyl 7-[4-[2-(cyclohexylcarbamoylamino)thiazol-4-yl]phenoxy]-2,2-dimethyl-heptanoate CAS Name: 7-[4-[2-[[(cyclohexylamino)-oxomethyl]amino]-4-thiazolyl]phenoxy]-2,2-dimethylheptanoic acid ethyl ester IUPAC Name: ethyl 7-[4-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]phenoxy]-2,2-dimethylheptanoate Traditional Name: 7-[4-[2-(cyclohexylcarbamoylamino)thiazol-4-yl]phenoxy]-2,2-dimethyl-enanthic acid ethyl ester Formula: C27H39N3O4S MolecularWeight: 501.68126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)NC3CCCCC3

Isomeric SMILES

CCOC(=O)C(C)(C)CCCCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)NC3CCCCC3

InChI

InChI=1S/C27H39N3O4S/c1-4-33-24(31)27(2,3)17-9-6-10-18-34-22-15-13-20(14-16-22)23-19-35-26(29-23)30-25(32)28-21-11-7-5-8-12-21/h13-16,19,21H,4-12,17-18H2,1-3H3,(H2,28,29,30,32)