5-azanyl-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-[(2S)-heptan-2-yl]-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-[(2S)-heptan-2-yl]-2H-pyrrol-3-one Openeye Name: 5-amino-4-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-1-[(1S)-1-methylhexyl]-2H-pyrrol-3-one CAS Name: 5-amino-4-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-1-[(2S)-heptan-2-yl]-2H-pyrrol-3-one IUPAC Name: 5-amino-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-[(2S)-heptan-2-yl]-2H-pyrrol-3-one Traditional Name: 5-amino-4-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-1-[(1S)-1-methylhexyl]-2-pyrrolin-3-one Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)N1CC(=O)C(=C1N)C2=NC(=CS2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCC[C@H](C)N1CC(=O)C(=C1N)C2=NC(=CS2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H29N3O3S/c1-5-6-7-8-14(2)25-12-17(26)20(21(25)23)22-24-16(13-29-22)15-9-10-18(27-3)19(11-15)28-4/h9-11,13-14H,5-8,12,23H2,1-4H3/t14-/m0/s1