2-[2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: 2-[2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: 2-[[2-[(4-allyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: 2-[[1-oxo-2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethyl]amino]benzamide IUPAC Name: 2-[[2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 2-[[2-[(4-allyl-5-isopropyl-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C17H21N5O2S MolecularWeight: 359.44594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1CC=C)SCC(=O)NC2=CC=CC=C2C(=O)N

Isomeric SMILES

CC(C)C1=NN=C(N1CC=C)SCC(=O)NC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C17H21N5O2S/c1-4-9-22-16(11(2)3)20-21-17(22)25-10-14(23)19-13-8-6-5-7-12(13)15(18)24/h4-8,11H,1,9-10H2,2-3H3,(H2,18,24)(H,19,23)