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

Systemtic Name: N-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-5-yl]benzamide Openeye Name: N-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]thiazol-5-yl]benzamide CAS Name: N-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)thio]-5-thiazolyl]benzamide IUPAC Name: N-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-5-yl]benzamide Traditional Name: N-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)thio]thiazol-5-yl]benzamide Formula: C22H21N5OS2 MolecularWeight: 435.56504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(N1C2=CC=CC=C2)SC3=NC=C(S3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN=C(N1C2=CC=CC=C2)SC3=NC=C(S3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5OS2/c1-22(2,3)19-25-26-20(27(19)16-12-8-5-9-13-16)30-21-23-14-17(29-21)24-18(28)15-10-6-4-7-11-15/h4-14H,1-3H3,(H,24,28)