N-ethyl-3-[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-ethyl-3-[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: 3-[[2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-ethyl-benzamide CAS Name: N-ethyl-3-[[1-oxo-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethyl]amino]benzamide IUPAC Name: N-ethyl-3-[[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 3-[[2-[(4-allyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-ethyl-benzamide Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=CN2CC=C

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=CN2CC=C

InChI

InChI=1S/C16H19N5O2S/c1-3-8-21-11-18-20-16(21)24-10-14(22)19-13-7-5-6-12(9-13)15(23)17-4-2/h3,5-7,9,11H,1,4,8,10H2,2H3,(H,17,23)(H,19,22)