N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclohexen-1-yl)-N-(2-furylmethyl)acetamide CAS Name: N-(1-cyclohexenyl)-N-(2-furanylmethyl)-2-[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(cyclohexen-1-yl)-N-(2-furfuryl)acetamide Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)N(CC2=CC=CO2)C3=CCCCC3)C4=CN=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)N(CC2=CC=CO2)C3=CCCCC3)C4=CN=CC=C4

InChI

InChI=1S/C23H25N5O2S/c1-2-13-27-22(18-8-6-12-24-15-18)25-26-23(27)31-17-21(29)28(16-20-11-7-14-30-20)19-9-4-3-5-10-19/h2,6-9,11-12,14-15H,1,3-5,10,13,16-17H2