3,4,5-trimethoxy-N-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3,4,5-trimethoxy-N-[5-(4-phenyl-1-piperazinyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[5-(4-phenylpiperazino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NN=C(S2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NN=C(S2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O4S/c1-29-17-13-15(14-18(30-2)19(17)31-3)20(28)23-21-24-25-22(32-21)27-11-9-26(10-12-27)16-7-5-4-6-8-16/h4-8,13-14H,9-12H2,1-3H3,(H,23,24,28)