3-[[2-[1-[5-oxidanylidene-1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]carbonylpiperidin-4-yl]imidazol-1-yl]methyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[[2-[1-[5-oxidanylidene-1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]carbonylpiperidin-4-yl]imidazol-1-yl]methyl]-1,3-benzothiazol-2-one Openeye Name: 3-[[2-[1-[5-oxo-1-(2-thienylmethyl)pyrrolidine-3-carbonyl]-4-piperidyl]imidazol-1-yl]methyl]-1,3-benzothiazol-2-one CAS Name: 3-[[2-[1-[oxo-[5-oxo-1-(thiophen-2-ylmethyl)-3-pyrrolidinyl]methyl]-4-piperidinyl]-1-imidazolyl]methyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[[2-[1-[5-oxo-1-(thiophen-2-ylmethyl)pyrrolidine-3-carbonyl]piperidin-4-yl]imidazol-1-yl]methyl]-1,3-benzothiazol-2-one Traditional Name: 3-[[2-[1-[5-keto-1-(2-thenyl)pyrrolidine-3-carbonyl]-4-piperidyl]imidazol-1-yl]methyl]-1,3-benzothiazol-2-one Formula: C26H27N5O3S2 MolecularWeight: 521.65428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4SC3=O)C(=O)C5CC(=O)N(C5)CC6=CC=CS6

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4SC3=O)C(=O)C5CC(=O)N(C5)CC6=CC=CS6

InChI

InChI=1S/C26H27N5O3S2/c32-23-14-19(15-30(23)16-20-4-3-13-35-20)25(33)28-10-7-18(8-11-28)24-27-9-12-29(24)17-31-21-5-1-2-6-22(21)36-26(31)34/h1-6,9,12-13,18-19H,7-8,10-11,14-17H2