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

Systemtic Name: 3-[4-cyclopropyl-5-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C15H19N5O3S MolecularWeight: 349.40806

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC(=O)NCC3=CC=CO3)CCC(=O)N

Isomeric SMILES

C1CC1N2C(=NN=C2SCC(=O)NCC3=CC=CO3)CCC(=O)N

InChI

InChI=1S/C15H19N5O3S/c16-12(21)5-6-13-18-19-15(20(13)10-3-4-10)24-9-14(22)17-8-11-2-1-7-23-11/h1-2,7,10H,3-6,8-9H2,(H2,16,21)(H,17,22)