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

Systemtic Name: N,N-dimethyl-4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N,N-dimethyl-4-[[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N,N-dimethyl-4-[[1-oxo-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]benzamide IUPAC Name: N,N-dimethyl-4-[[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N,N-dimethyl-4-[[2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)C(=O)N(C)C

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)C(=O)N(C)C

InChI

InChI=1S/C16H21N5O2S/c1-4-5-13-18-16(20-19-13)24-10-14(22)17-12-8-6-11(7-9-12)15(23)21(2)3/h6-9H,4-5,10H2,1-3H3,(H,17,22)(H,18,19,20)