2-[[5-(4-cyclopentyloxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-(4-cyclopentyloxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-[4-(cyclopentoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(4-cyclopentyloxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-(4-cyclopentyloxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-[4-(cyclopentoxy)phenyl]-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)N)C2=CC=C(C=C2)OC3CCCC3

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)N)C2=CC=C(C=C2)OC3CCCC3

InChI

InChI=1S/C18H22N4O2S/c1-2-11-22-17(20-21-18(22)25-12-16(19)23)13-7-9-15(10-8-13)24-14-5-3-4-6-14/h2,7-10,14H,1,3-6,11-12H2,(H2,19,23)