3-[3-(but-1-en-2-ylamino)propyl]-2-(4-nitrophenyl)-1,3-thiazolidin-4-one hydrochloride

Systemtic Name: 3-[3-(but-1-en-2-ylamino)propyl]-2-(4-nitrophenyl)-1,3-thiazolidin-4-one hydrochloride Openeye Name: 3-[3-(1-methylenepropylamino)propyl]-2-(4-nitrophenyl)thiazolidin-4-one hydrochloride CAS Name: 3-[3-(but-1-en-2-ylamino)propyl]-2-(4-nitrophenyl)-4-thiazolidinone hydrochloride IUPAC Name: 3-[3-(but-1-en-2-ylamino)propyl]-2-(4-nitrophenyl)-1,3-thiazolidin-4-one hydrochloride Traditional Name: 3-[3-(1-ethylvinylamino)propyl]-2-(4-nitrophenyl)thiazolidin-4-one hydrochloride Formula: C16H22ClN3O3S MolecularWeight: 371.88218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)NCCCN1C(SCC1=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CCC(=C)NCCCN1C(SCC1=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C16H21N3O3S.ClH/c1-3-12(2)17-9-4-10-18-15(20)11-23-16(18)13-5-7-14(8-6-13)19(21)22;/h5-8,16-17H,2-4,9-11H2,1H3;1H