N-tert-butyl-5-[oxidanyl(diphenyl)methyl]pyrazine-2-carbothioamide

Systemtic Name: N-tert-butyl-5-[oxidanyl(diphenyl)methyl]pyrazine-2-carbothioamide Openeye Name: N-tert-butyl-5-[hydroxy(diphenyl)methyl]pyrazine-2-carbothioamide CAS Name: N-tert-butyl-5-[hydroxy(diphenyl)methyl]-2-pyrazinecarbothioamide IUPAC Name: N-tert-butyl-5-[hydroxy(diphenyl)methyl]pyrazine-2-carbothioamide Traditional Name: N-tert-butyl-5-[hydroxy(diphenyl)methyl]thiopyrazinamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)C1=CN=C(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)NC(=S)C1=CN=C(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O

InChI

InChI=1S/C22H23N3OS/c1-21(2,3)25-20(27)18-14-24-19(15-23-18)22(26,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-15,26H,1-3H3,(H,25,27)