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

Systemtic Name: N-(butylcarbamoyl)-2-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(butylcarbamoyl)-2-[[4-cyclohexyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[butylamino(oxo)methyl]-2-[[4-cyclohexyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(butylcarbamoyl)-2-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(butylcarbamoyl)-2-[[4-cyclohexyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H29N5O3S MolecularWeight: 419.54096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C(C)SC1=NN=C(N1C2CCCCC2)C3=CC=CO3

Isomeric SMILES

CCCCNC(=O)NC(=O)C(C)SC1=NN=C(N1C2CCCCC2)C3=CC=CO3

InChI

InChI=1S/C20H29N5O3S/c1-3-4-12-21-19(27)22-18(26)14(2)29-20-24-23-17(16-11-8-13-28-16)25(20)15-9-6-5-7-10-15/h8,11,13-15H,3-7,9-10,12H2,1-2H3,(H2,21,22,26,27)