N-(cyclopenten-1-yl)-2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-(cyclopenten-1-yl)-2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide Openeye Name: N-(cyclopenten-1-yl)-2-[[4-(2-furylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide CAS Name: N-(1-cyclopentenyl)-2-[[4-(2-furanylmethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-methylacetamide IUPAC Name: N-(cyclopenten-1-yl)-2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide Traditional Name: N-(cyclopenten-1-yl)-2-[[4-(2-furfuryl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CCCC1)C(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

CN(C1=CCCC1)C(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c1-24(17-10-5-6-11-17)19(26)15-28-21-23-22-20(16-8-3-2-4-9-16)25(21)14-18-12-7-13-27-18/h2-4,7-10,12-13H,5-6,11,14-15H2,1H3