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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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