3-(2-methylpropylsulfonyl)-N-prop-2-enyl-N-prop-2-ynyl-1,2,4-triazole-1-carboxamide

Systemtic Name: 3-(2-methylpropylsulfonyl)-N-prop-2-enyl-N-prop-2-ynyl-1,2,4-triazole-1-carboxamide Openeye Name: N-allyl-3-isobutylsulfonyl-N-prop-2-ynyl-1,2,4-triazole-1-carboxamide CAS Name: 3-(2-methylpropylsulfonyl)-N-prop-2-enyl-N-prop-2-ynyl-1,2,4-triazole-1-carboxamide IUPAC Name: 3-(2-methylpropylsulfonyl)-N-prop-2-enyl-N-prop-2-ynyl-1,2,4-triazole-1-carboxamide Traditional Name: N-allyl-3-isobutylsulfonyl-N-propargyl-1,2,4-triazole-1-carboxamide Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=NN(C=N1)C(=O)N(CC=C)CC#C

Isomeric SMILES

CC(C)CS(=O)(=O)C1=NN(C=N1)C(=O)N(CC=C)CC#C

InChI

InChI=1S/C13H18N4O3S/c1-5-7-16(8-6-2)13(18)17-10-14-12(15-17)21(19,20)9-11(3)4/h1,6,10-11H,2,7-9H2,3-4H3