5-methyl-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: 5-methyl-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-(3-allyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-1-isopropyl-5-methyl-pyrazole-3-carboxamide CAS Name: 5-methyl-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: 5-methyl-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-(3-allyl-6-mesyl-1,3-benzothiazol-2-ylidene)-1-isopropyl-5-methyl-pyrazole-3-carboxamide Formula: C19H22N4O3S2 MolecularWeight: 418.53298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)C)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)CC=C

Isomeric SMILES

CC1=CC(=NN1C(C)C)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)CC=C

InChI

InChI=1S/C19H22N4O3S2/c1-6-9-22-16-8-7-14(28(5,25)26)11-17(16)27-19(22)20-18(24)15-10-13(4)23(21-15)12(2)3/h6-8,10-12H,1,9H2,2-5H3