3-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]-4-(diethylamino)benzenesulfonamide

Systemtic Name: 3-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]-4-(diethylamino)benzenesulfonamide Openeye Name: 3-[[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]amino]-4-(diethylamino)benzenesulfonamide CAS Name: 3-[[(E)-2-cyano-2-(4-methyl-2-thiazolyl)ethenyl]amino]-4-(diethylamino)benzenesulfonamide IUPAC Name: 3-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]-4-(diethylamino)benzenesulfonamide Traditional Name: 3-[[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]amino]-4-(diethylamino)benzenesulfonamide Formula: C17H21N5O2S2 MolecularWeight: 391.51094

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N)NC=C(C#N)C2=NC(=CS2)C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N)N/C=C(\C#N)/C2=NC(=CS2)C

InChI

InChI=1S/C17H21N5O2S2/c1-4-22(5-2)16-7-6-14(26(19,23)24)8-15(16)20-10-13(9-18)17-21-12(3)11-25-17/h6-8,10-11,20H,4-5H2,1-3H3,(H2,19,23,24)/b13-10+