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

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-3-piperidyl]methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-[1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-3-piperidinyl]methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-[1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-3-piperidyl]methanone Formula: C20H24N8OS MolecularWeight: 424.52256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(S2)N3C=CC=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CC(CN(C1)C2=NN=C(S2)N3C=CC=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C20H24N8OS/c29-17(25-11-13-26(14-12-25)18-21-6-4-7-22-18)16-5-3-10-28(15-16)20-24-23-19(30-20)27-8-1-2-9-27/h1-2,4,6-9,16H,3,5,10-15H2