N-(2-chloranylprop-2-enyl)-3-(2-methylpropylsulfonyl)-N-propyl-1,2,4-triazole-1-carboxamide

Systemtic Name: N-(2-chloranylprop-2-enyl)-3-(2-methylpropylsulfonyl)-N-propyl-1,2,4-triazole-1-carboxamide Openeye Name: N-(2-chloroallyl)-3-isobutylsulfonyl-N-propyl-1,2,4-triazole-1-carboxamide CAS Name: N-(2-chloroprop-2-enyl)-3-(2-methylpropylsulfonyl)-N-propyl-1,2,4-triazole-1-carboxamide IUPAC Name: N-(2-chloroprop-2-enyl)-3-(2-methylpropylsulfonyl)-N-propyl-1,2,4-triazole-1-carboxamide Traditional Name: N-(2-chloroallyl)-3-isobutylsulfonyl-N-propyl-1,2,4-triazole-1-carboxamide Formula: C13H21ClN4O3S MolecularWeight: 348.84884

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=C)Cl)C(=O)N1C=NC(=N1)S(=O)(=O)CC(C)C

Isomeric SMILES

CCCN(CC(=C)Cl)C(=O)N1C=NC(=N1)S(=O)(=O)CC(C)C

InChI

InChI=1S/C13H21ClN4O3S/c1-5-6-17(7-11(4)14)13(19)18-9-15-12(16-18)22(20,21)8-10(2)3/h9-10H,4-8H2,1-3H3