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

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

Systemtic Name:4-(butanoylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide
Openeye Name:4-(butanoylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide
CAS Name:4-(1-oxobutylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide
IUPAC Name:4-(butanoylamino)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)benzamide
Traditional Name:4-butyramido-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:

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


Isomeric SMILES

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


InChI

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


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