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

Systemtic Name: N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(cyclohexen-1-yl)-N-(2-furylmethyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(1-cyclohexenyl)-N-(2-furanylmethyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(cyclohexen-1-yl)-N-(2-furfuryl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)N(CC3=CC=CO3)C4=CCCCC4

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)N(CC3=CC=CO3)C4=CCCCC4

InChI

InChI=1S/C22H24N4O2S/c1-17-23-24-22(26(17)19-11-6-3-7-12-19)29-16-21(27)25(15-20-13-8-14-28-20)18-9-4-2-5-10-18/h3,6-9,11-14H,2,4-5,10,15-16H2,1H3