4-tert-butyl-N-[2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide Openeye Name: 4-tert-butyl-N-[2-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]benzamide CAS Name: 4-tert-butyl-N-[2-[[2-(cyclopropylamino)-2-oxoethyl]thio]-4-phenyl-5-thiazolyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide Traditional Name: 4-tert-butyl-N-[2-[[2-(cyclopropylamino)-2-keto-ethyl]thio]-4-phenyl-thiazol-5-yl]benzamide Formula: C25H27N3O2S2 MolecularWeight: 465.63078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(N=C(S2)SCC(=O)NC3CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(N=C(S2)SCC(=O)NC3CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2S2/c1-25(2,3)18-11-9-17(10-12-18)22(30)28-23-21(16-7-5-4-6-8-16)27-24(32-23)31-15-20(29)26-19-13-14-19/h4-12,19H,13-15H2,1-3H3,(H,26,29)(H,28,30)