N-(butylcarbamoyl)-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(butylcarbamoyl)-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(butylcarbamoyl)acetamide CAS Name: N-[butylamino(oxo)methyl]-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(butylcarbamoyl)-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(butylcarbamoyl)acetamide Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)CSC1=NN=C(N1CC=C)C2=CC=CC=C2OC

Isomeric SMILES

CCCCNC(=O)NC(=O)CSC1=NN=C(N1CC=C)C2=CC=CC=C2OC

InChI

InChI=1S/C19H25N5O3S/c1-4-6-11-20-18(26)21-16(25)13-28-19-23-22-17(24(19)12-5-2)14-9-7-8-10-15(14)27-3/h5,7-10H,2,4,6,11-13H2,1,3H3,(H2,20,21,25,26)