2-[[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-1-piperidino-ethanone Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NN=C(S2)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NN=C(S2)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S2/c26-19(25-13-5-2-6-14-25)15-28-21-24-23-20(29-21)22-16-9-11-18(12-10-16)27-17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-15H2,(H,22,23)