2-[[5-(furan-2-yl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[[5-(furan-2-yl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[[5-(2-furyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[5-(2-furanyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[[5-(furan-2-yl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[5-(2-furyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]-1-pyrrolidino-ethanone Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NN=C1SCC(=O)N2CCCC2)C3=CC=CO3

Isomeric SMILES

COCCCN1C(=NN=C1SCC(=O)N2CCCC2)C3=CC=CO3

InChI

InChI=1S/C16H22N4O3S/c1-22-10-5-9-20-15(13-6-4-11-23-13)17-18-16(20)24-12-14(21)19-7-2-3-8-19/h4,6,11H,2-3,5,7-10,12H2,1H3