2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone Openeye Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone CAS Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-1-[4-(2-phenoxyethyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone Traditional Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-1-[4-(2-phenoxyethyl)piperazino]ethanone Formula: C19H25N5O2S MolecularWeight: 387.4991

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2)SCC(=O)N3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NC(=NN2)SCC(=O)N3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C19H25N5O2S/c25-17(14-27-19-20-18(21-22-19)15-6-7-15)24-10-8-23(9-11-24)12-13-26-16-4-2-1-3-5-16/h1-5,15H,6-14H2,(H,20,21,22)