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

Systemtic Name: 2-[[4-(3-methoxypropyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[[5-benzyl-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[4-(3-methoxypropyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[[5-benzyl-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[5-benzyl-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]-1-pyrrolidino-ethanone Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NN=C1SCC(=O)N2CCCC2)CC3=CC=CC=C3

Isomeric SMILES

COCCCN1C(=NN=C1SCC(=O)N2CCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H26N4O2S/c1-25-13-7-12-23-17(14-16-8-3-2-4-9-16)20-21-19(23)26-15-18(24)22-10-5-6-11-22/h2-4,8-9H,5-7,10-15H2,1H3