(NE)-4-chloranyl-N-[2-(4-methoxyphenyl)-4-piperidin-1-ylcarbonyl-1,2,3-thiadiazol-5-ylidene]benzenesulfonamide

Systemtic Name: (NE)-4-chloranyl-N-[2-(4-methoxyphenyl)-4-piperidin-1-ylcarbonyl-1,2,3-thiadiazol-5-ylidene]benzenesulfonamide Openeye Name: (NE)-4-chloro-N-[2-(4-methoxyphenyl)-4-(piperidine-1-carbonyl)thiadiazol-5-ylidene]benzenesulfonamide CAS Name: (NE)-4-chloro-N-[2-(4-methoxyphenyl)-4-[oxo(1-piperidinyl)methyl]-5-thiadiazolylidene]benzenesulfonamide IUPAC Name: (NE)-4-chloro-N-[2-(4-methoxyphenyl)-4-(piperidine-1-carbonyl)thiadiazol-5-ylidene]benzenesulfonamide Traditional Name: (NE)-4-chloro-N-[2-(4-methoxyphenyl)-4-(piperidine-1-carbonyl)thiadiazol-5-ylidene]benzenesulfonamide Formula: C21H21ClN4O4S2 MolecularWeight: 492.99884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2N=C(C(=NS(=O)(=O)C3=CC=C(C=C3)Cl)S2)C(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2N=C(/C(=N\S(=O)(=O)C3=CC=C(C=C3)Cl)/S2)C(=O)N4CCCCC4

InChI

InChI=1S/C21H21ClN4O4S2/c1-30-17-9-7-16(8-10-17)26-23-19(21(27)25-13-3-2-4-14-25)20(31-26)24-32(28,29)18-11-5-15(22)6-12-18/h5-12H,2-4,13-14H2,1H3/b24-20+