4-[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide

Systemtic Name: 4-[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide Openeye Name: 4-[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide CAS Name: 4-[[1-oxo-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propyl]amino]benzamide IUPAC Name: 4-[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide Traditional Name: 4-[2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propanoylamino]benzamide Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C18H17N5O2S/c1-12(17(25)21-14-9-7-13(8-10-14)16(19)24)26-18-22-20-11-23(18)15-5-3-2-4-6-15/h2-12H,1H3,(H2,19,24)(H,21,25)