N'-[(4-chlorophenyl)methyl]-5-methyl-2-(4-methylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-1,3,4-thiadiazole-3-carboximidamide

Systemtic Name: N'-[(4-chlorophenyl)methyl]-5-methyl-2-(4-methylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-1,3,4-thiadiazole-3-carboximidamide Openeye Name: N'-[(4-chlorophenyl)methyl]-5-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(p-tolyl)-2H-1,3,4-thiadiazole-3-carboxamidine CAS Name: N'-[(4-chlorophenyl)methyl]-5-methyl-2-(4-methylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-1,3,4-thiadiazole-3-carboximidamide IUPAC Name: N'-[(4-chlorophenyl)methyl]-5-methyl-2-(4-methylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-1,3,4-thiadiazole-3-carboximidamide Traditional Name: N'-(4-chlorobenzyl)-5-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(p-tolyl)-2H-1,3,4-thiadiazole-3-carboxamidine Formula: C21H21ClN6S2 MolecularWeight: 457.01464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2N(N=C(S2)C)C(=NCC3=CC=C(C=C3)Cl)NC4=NN=C(S4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2N(N=C(S2)C)C(=NCC3=CC=C(C=C3)Cl)NC4=NN=C(S4)C

InChI

InChI=1S/C21H21ClN6S2/c1-13-4-8-17(9-5-13)19-28(27-15(3)29-19)20(24-21-26-25-14(2)30-21)23-12-16-6-10-18(22)11-7-16/h4-11,19H,12H2,1-3H3,(H,23,24,26)