N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)sulfonyl-butanamide

Systemtic Name: N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)sulfonyl-butanamide Openeye Name: N-[4-(4-cyanophenyl)thiazol-2-yl]-4-(4-methoxyphenyl)sulfonyl-butanamide CAS Name: N-[4-(4-cyanophenyl)-2-thiazolyl]-4-(4-methoxyphenyl)sulfonylbutanamide IUPAC Name: N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenyl)sulfonylbutanamide Traditional Name: N-[4-(4-cyanophenyl)thiazol-2-yl]-4-(4-methoxyphenyl)sulfonyl-butyramide Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H19N3O4S2/c1-28-17-8-10-18(11-9-17)30(26,27)12-2-3-20(25)24-21-23-19(14-29-21)16-6-4-15(13-22)5-7-16/h4-11,14H,2-3,12H2,1H3,(H,23,24,25)