(4-phenylpiperazin-1-yl)-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanone

Systemtic Name: (4-phenylpiperazin-1-yl)-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanone Openeye Name: (4-phenylpiperazin-1-yl)-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-3-piperidyl]methanone CAS Name: (4-phenyl-1-piperazinyl)-[1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-3-piperidinyl]methanone IUPAC Name: (4-phenylpiperazin-1-yl)-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanone Traditional Name: (4-phenylpiperazino)-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-3-piperidyl]methanone Formula: C22H26N6OS MolecularWeight: 422.54644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(S2)N3C=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)C2=NN=C(S2)N3C=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C22H26N6OS/c29-20(26-15-13-25(14-16-26)19-8-2-1-3-9-19)18-7-6-12-28(17-18)22-24-23-21(30-22)27-10-4-5-11-27/h1-5,8-11,18H,6-7,12-17H2