N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-N'-(phenylsulfonyl)benzenecarboximidamide

Systemtic Name: N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-N'-(phenylsulfonyl)benzenecarboximidamide Openeye Name: N'-(benzenesulfonyl)-N-(5-tert-butyl-4-methyl-thiazol-2-yl)benzamidine CAS Name: N'-(benzenesulfonyl)-N-(5-tert-butyl-4-methyl-2-thiazolyl)benzenecarboximidamide IUPAC Name: N'-(benzenesulfonyl)-N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)benzenecarboximidamide Traditional Name: N'-besyl-N-(5-tert-butyl-4-methyl-thiazol-2-yl)benzamidine Formula: C21H23N3O2S2 MolecularWeight: 413.55622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=NS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC1=C(SC(=N1)N/C(=N/S(=O)(=O)C2=CC=CC=C2)/C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C21H23N3O2S2/c1-15-18(21(2,3)4)27-20(22-15)23-19(16-11-7-5-8-12-16)24-28(25,26)17-13-9-6-10-14-17/h5-14H,1-4H3,(H,22,23,24)