3-[4-(furan-2-ylmethyl)-5-(2-naphthalen-2-yloxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-(furan-2-ylmethyl)-5-(2-naphthalen-2-yloxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-(2-furylmethyl)-5-[2-(2-naphthyloxy)ethylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-(2-furanylmethyl)-5-[2-(2-naphthalenyloxy)ethylthio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-(furan-2-ylmethyl)-5-(2-naphthalen-2-yloxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-(2-furfuryl)-5-[2-(2-naphthoxy)ethylthio]-1,2,4-triazol-3-yl]propionamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OCCSC3=NN=C(N3CC4=CC=CO4)CCC(=O)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OCCSC3=NN=C(N3CC4=CC=CO4)CCC(=O)N

InChI

InChI=1S/C22H22N4O3S/c23-20(27)9-10-21-24-25-22(26(21)15-19-6-3-11-28-19)30-13-12-29-18-8-7-16-4-1-2-5-17(16)14-18/h1-8,11,14H,9-10,12-13,15H2,(H2,23,27)