5-azanyl-1-cyclooctyl-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-1-cyclooctyl-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2H-pyrrol-3-one Openeye Name: 5-amino-1-cyclooctyl-4-[4-(4-methoxyphenyl)thiazol-2-yl]-2H-pyrrol-3-one CAS Name: 5-amino-1-cyclooctyl-4-[4-(4-methoxyphenyl)-2-thiazolyl]-2H-pyrrol-3-one IUPAC Name: 5-amino-1-cyclooctyl-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2H-pyrrol-3-one Traditional Name: 5-amino-1-cyclooctyl-4-[4-(4-methoxyphenyl)thiazol-2-yl]-2-pyrrolin-3-one Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)C3=C(N(CC3=O)C4CCCCCCC4)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)C3=C(N(CC3=O)C4CCCCCCC4)N

InChI

InChI=1S/C22H27N3O2S/c1-27-17-11-9-15(10-12-17)18-14-28-22(24-18)20-19(26)13-25(21(20)23)16-7-5-3-2-4-6-8-16/h9-12,14,16H,2-8,13,23H2,1H3