4-(2-methylpropanoylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-(2-methylpropanoylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-(2-methylpropanoylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-[(2-methyl-1-oxopropyl)amino]-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-(2-methylpropanoylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-(isobutyrylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-14(2)19(26)22-17-11-9-16(10-12-17)20(27)23-21-25-24-18(28-21)13-8-15-6-4-3-5-7-15/h3-7,9-12,14H,8,13H2,1-2H3,(H,22,26)(H,23,25,27)