N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C21H21ClN4O4S2 MolecularWeight: 492.99884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=C(S3)C4=CC=CC=C4Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=C(S3)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H21ClN4O4S2/c1-30-15-6-8-16(9-7-15)32(28,29)26-12-10-14(11-13-26)19(27)23-21-25-24-20(31-21)17-4-2-3-5-18(17)22/h2-9,14H,10-13H2,1H3,(H,23,25,27)