6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-1-ethyl-3-methyl-quinoxalin-2-one

Systemtic Name: 6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-1-ethyl-3-methyl-quinoxalin-2-one Openeye Name: 6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-1-ethyl-3-methyl-quinoxalin-2-one CAS Name: 6-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-1-ethyl-3-methyl-2-quinoxalinone IUPAC Name: 6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-1-ethyl-3-methylquinoxalin-2-one Traditional Name: 6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-1-ethyl-3-methyl-quinoxalin-2-one Formula: C23H22N4O2S MolecularWeight: 418.51138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCCC3C4=NC5=CC=CC=C5S4)N=C(C1=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCC[C@H]3C4=NC5=CC=CC=C5S4)N=C(C1=O)C

InChI

InChI=1S/C23H22N4O2S/c1-3-26-18-11-10-15(13-17(18)24-14(2)22(26)28)23(29)27-12-6-8-19(27)21-25-16-7-4-5-9-20(16)30-21/h4-5,7,9-11,13,19H,3,6,8,12H2,1-2H3/t19-/m0/s1