2-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide

Systemtic Name: 2-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-isopropylpyrazol-3-yl)propanamide CAS Name: 2-[[4-cyclohexyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-N-(2-propan-2-yl-3-pyrazolyl)propanamide IUPAC Name: 2-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide Traditional Name: 2-[[4-cyclohexyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-(2-isopropylpyrazol-3-yl)propionamide Formula: C21H28N6O2S MolecularWeight: 428.55102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)C(C)SC2=NN=C(N2C3CCCCC3)C4=CC=CO4

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)C(C)SC2=NN=C(N2C3CCCCC3)C4=CC=CO4

InChI

InChI=1S/C21H28N6O2S/c1-14(2)27-18(11-12-22-27)23-20(28)15(3)30-21-25-24-19(17-10-7-13-29-17)26(21)16-8-5-4-6-9-16/h7,10-16H,4-6,8-9H2,1-3H3,(H,23,28)