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

Systemtic Name: 3-[4-(furan-2-ylmethyl)-5-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-(2-furylmethyl)-5-[2-(2-naphthyl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-(2-furanylmethyl)-5-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-(furan-2-ylmethyl)-5-(2-naphthalen-2-yl-2-oxoethyl)sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-(2-furfuryl)-5-[[2-keto-2-(2-naphthyl)ethyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)CSC3=NN=C(N3CC4=CC=CO4)CCC(=O)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)CSC3=NN=C(N3CC4=CC=CO4)CCC(=O)N

InChI

InChI=1S/C22H20N4O3S/c23-20(28)9-10-21-24-25-22(26(21)13-18-6-3-11-29-18)30-14-19(27)17-8-7-15-4-1-2-5-16(15)12-17/h1-8,11-12H,9-10,13-14H2,(H2,23,28)