4-tert-butyl-N-[5-[[4-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-phenyl]sulfanylmethyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[5-[[4-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-phenyl]sulfanylmethyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[5-[[4-methyl-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]sulfanylmethyl]thiazol-2-yl]benzamide CAS Name: 4-tert-butyl-N-[5-[[[4-methyl-3-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]thio]methyl]-2-thiazolyl]benzamide IUPAC Name: 4-tert-butyl-N-[5-[[4-methyl-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]sulfanylmethyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[5-[[[4-methyl-3-[4-(2-pyrimidyl)piperazine-1-carbonyl]phenyl]thio]methyl]thiazol-2-yl]benzamide Formula: C31H34N6O2S2 MolecularWeight: 586.77066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=C(C=C(C=C1)SCC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C31H34N6O2S2/c1-21-6-11-24(18-26(21)28(39)36-14-16-37(17-15-36)29-32-12-5-13-33-29)40-20-25-19-34-30(41-25)35-27(38)22-7-9-23(10-8-22)31(2,3)4/h5-13,18-19H,14-17,20H2,1-4H3,(H,34,35,38)