N,N-diethyl-3-[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoylamino]benzamide

Systemtic Name: N,N-diethyl-3-[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoylamino]benzamide Openeye Name: N,N-diethyl-3-[[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]amino]benzamide CAS Name: N,N-diethyl-3-[[1-oxo-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]amino]benzamide IUPAC Name: N,N-diethyl-3-[[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetyl]amino]benzamide Traditional Name: N,N-diethyl-3-[[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]amino]benzamide Formula: C18H25N5O2S MolecularWeight: 375.4884

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC2=CC=CC(=C2)C(=O)N(CC)CC

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC2=CC=CC(=C2)C(=O)N(CC)CC

InChI

InChI=1S/C18H25N5O2S/c1-4-8-15-20-21-18(26)23(15)12-16(24)19-14-10-7-9-13(11-14)17(25)22(5-2)6-3/h7,9-11H,4-6,8,12H2,1-3H3,(H,19,24)(H,21,26)