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

Systemtic Name: tert-butyl 2-[4-(diphenylmethylidene)piperidin-1-yl]-4-[(2-pyridin-3-yl-1,3-thiazolidin-2-yl)carbonylamino]butanoate Openeye Name: tert-butyl 2-(4-benzhydrylidene-1-piperidyl)-4-[[2-(3-pyridyl)thiazolidine-2-carbonyl]amino]butanoate CAS Name: 2-[4-(diphenylmethylene)-1-piperidinyl]-4-[[oxo-[2-(3-pyridinyl)-2-thiazolidinyl]methyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-benzhydrylidenepiperidin-1-yl)-4-[(2-pyridin-3-yl-1,3-thiazolidine-2-carbonyl)amino]butanoate Traditional Name: 2-(4-benzhydrylidenepiperidino)-4-[[2-(3-pyridyl)thiazolidine-2-carbonyl]amino]butyric acid tert-butyl ester Formula: C35H42N4O3S MolecularWeight: 598.79798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCNC(=O)C1(NCCS1)C2=CN=CC=C2)N3CCC(=C(C4=CC=CC=C4)C5=CC=CC=C5)CC3

Isomeric SMILES

CC(C)(C)OC(=O)C(CCNC(=O)C1(NCCS1)C2=CN=CC=C2)N3CCC(=C(C4=CC=CC=C4)C5=CC=CC=C5)CC3

InChI

InChI=1S/C35H42N4O3S/c1-34(2,3)42-32(40)30(16-20-37-33(41)35(38-21-24-43-35)29-15-10-19-36-25-29)39-22-17-28(18-23-39)31(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-15,19,25,30,38H,16-18,20-24H2,1-3H3,(H,37,41)