5-azanyl-4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1-[(2S)-6-methylheptan-2-yl]-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1-[(2S)-6-methylheptan-2-yl]-2H-pyrrol-3-one Openeye Name: 5-amino-4-[4-(4-chlorophenyl)thiazol-2-yl]-1-[(1S)-1,5-dimethylhexyl]-2H-pyrrol-3-one CAS Name: 5-amino-4-[4-(4-chlorophenyl)-2-thiazolyl]-1-[(2S)-6-methylheptan-2-yl]-2H-pyrrol-3-one IUPAC Name: 5-amino-4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1-[(2S)-6-methylheptan-2-yl]-2H-pyrrol-3-one Traditional Name: 5-amino-4-[4-(4-chlorophenyl)thiazol-2-yl]-1-[(1S)-1,5-dimethylhexyl]-2-pyrrolin-3-one Formula: C21H26ClN3OS MolecularWeight: 403.96864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)N1CC(=O)C(=C1N)C2=NC(=CS2)C3=CC=C(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3OS/c1-13(2)5-4-6-14(3)25-11-18(26)19(20(25)23)21-24-17(12-27-21)15-7-9-16(22)10-8-15/h7-10,12-14H,4-6,11,23H2,1-3H3/t14-/m0/s1