3-[3-cyclopropyl-5-[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-cyclopropyl-5-[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-cyclopropyl-5-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-cyclopropyl-5-[[2-oxo-2-(2-phenoxyethylamino)ethyl]thio]-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-cyclopropyl-5-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-cyclopropyl-5-[[2-keto-2-(2-phenoxyethylamino)ethyl]thio]-1,2,4-triazol-4-yl]propionamide Formula: C18H23N5O3S MolecularWeight: 389.47192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2CCC(=O)N)SCC(=O)NCCOC3=CC=CC=C3

Isomeric SMILES

C1CC1C2=NN=C(N2CCC(=O)N)SCC(=O)NCCOC3=CC=CC=C3

InChI

InChI=1S/C18H23N5O3S/c19-15(24)8-10-23-17(13-6-7-13)21-22-18(23)27-12-16(25)20-9-11-26-14-4-2-1-3-5-14/h1-5,13H,6-12H2,(H2,19,24)(H,20,25)