tert-butyl 2-[4-(diphenylmethyl)piperazin-1-yl]-4-[(2-pyridin-3-yl-1,3-thiazolidin-2-yl)carbonylamino]butanoate

Systemtic Name: tert-butyl 2-[4-(diphenylmethyl)piperazin-1-yl]-4-[(2-pyridin-3-yl-1,3-thiazolidin-2-yl)carbonylamino]butanoate Openeye Name: tert-butyl 2-(4-benzhydrylpiperazin-1-yl)-4-[[2-(3-pyridyl)thiazolidine-2-carbonyl]amino]butanoate CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-4-[[oxo-[2-(3-pyridinyl)-2-thiazolidinyl]methyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-benzhydrylpiperazin-1-yl)-4-[(2-pyridin-3-yl-1,3-thiazolidine-2-carbonyl)amino]butanoate Traditional Name: 2-(4-benzhydrylpiperazino)-4-[[2-(3-pyridyl)thiazolidine-2-carbonyl]amino]butyric acid tert-butyl ester Formula: C34H43N5O3S MolecularWeight: 601.80192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCNC(=O)C1(NCCS1)C2=CN=CC=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)C(CCNC(=O)C1(NCCS1)C2=CN=CC=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H43N5O3S/c1-33(2,3)42-31(40)29(16-18-36-32(41)34(37-19-24-43-34)28-15-10-17-35-25-28)38-20-22-39(23-21-38)30(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-15,17,25,29-30,37H,16,18-24H2,1-3H3,(H,36,41)