3-(2-azanyl-6-chloranyl-phenyl)sulfanyl-1-butan-2-yl-pyrrolidine-2,5-dione

Systemtic Name: 3-(2-azanyl-6-chloranyl-phenyl)sulfanyl-1-butan-2-yl-pyrrolidine-2,5-dione Openeye Name: 3-(2-amino-6-chloro-phenyl)sulfanyl-1-sec-butyl-pyrrolidine-2,5-dione CAS Name: 3-[(2-amino-6-chlorophenyl)thio]-1-butan-2-ylpyrrolidine-2,5-dione IUPAC Name: 3-(2-amino-6-chlorophenyl)sulfanyl-1-butan-2-ylpyrrolidine-2,5-dione Traditional Name: 3-[(2-amino-6-chloro-phenyl)thio]-1-sec-butyl-pyrrolidine-2,5-quinone Formula: C14H17ClN2O2S MolecularWeight: 312.81498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)CC(C1=O)SC2=C(C=CC=C2Cl)N

Isomeric SMILES

CCC(C)N1C(=O)CC(C1=O)SC2=C(C=CC=C2Cl)N

InChI

InChI=1S/C14H17ClN2O2S/c1-3-8(2)17-12(18)7-11(14(17)19)20-13-9(15)5-4-6-10(13)16/h4-6,8,11H,3,7,16H2,1-2H3