N-[4-methyl-5-(2-methylbutan-2-yl)-1,3-thiazol-2-yl]-N'-(phenylsulfonyl)benzenecarboximidamide

Systemtic Name: N-[4-methyl-5-(2-methylbutan-2-yl)-1,3-thiazol-2-yl]-N'-(phenylsulfonyl)benzenecarboximidamide Openeye Name: N'-(benzenesulfonyl)-N-[5-(1,1-dimethylpropyl)-4-methyl-thiazol-2-yl]benzamidine CAS Name: N'-(benzenesulfonyl)-N-[4-methyl-5-(2-methylbutan-2-yl)-2-thiazolyl]benzenecarboximidamide IUPAC Name: N'-(benzenesulfonyl)-N-[4-methyl-5-(2-methylbutan-2-yl)-1,3-thiazol-2-yl]benzenecarboximidamide Traditional Name: N-(5-tert-amyl-4-methyl-thiazol-2-yl)-N'-besyl-benzamidine Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=C(N=C(S1)NC(=NS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C)(C)C1=C(N=C(S1)N/C(=N/S(=O)(=O)C2=CC=CC=C2)/C3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3O2S2/c1-5-22(3,4)19-16(2)23-21(28-19)24-20(17-12-8-6-9-13-17)25-29(26,27)18-14-10-7-11-15-18/h6-15H,5H2,1-4H3,(H,23,24,25)