N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-acetamide CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[[6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanylacetamide Traditional Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[[6-(4-phenylpiperazino)pyrimidin-4-yl]thio]acetamide Formula: C19H21N7OS2 MolecularWeight: 427.54634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(S1)NC(=O)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C19H21N7OS2/c1-14-23-24-19(29-14)22-17(27)12-28-18-11-16(20-13-21-18)26-9-7-25(8-10-26)15-5-3-2-4-6-15/h2-6,11,13H,7-10,12H2,1H3,(H,22,24,27)