[4-(2-methylsulfanyl-3-phenyl-imidazol-4-yl)carbonylpiperazin-1-yl]-pyridin-2-yl-methanone

Systemtic Name: [4-(2-methylsulfanyl-3-phenyl-imidazol-4-yl)carbonylpiperazin-1-yl]-pyridin-2-yl-methanone Openeye Name: [4-(2-methylsulfanyl-3-phenyl-imidazole-4-carbonyl)piperazin-1-yl]-(2-pyridyl)methanone CAS Name: [4-[[2-(methylthio)-3-phenyl-4-imidazolyl]-oxomethyl]-1-piperazinyl]-(2-pyridinyl)methanone IUPAC Name: [4-(2-methylsulfanyl-3-phenylimidazole-4-carbonyl)piperazin-1-yl]-pyridin-2-ylmethanone Traditional Name: [4-[2-(methylthio)-3-phenyl-imidazole-4-carbonyl]piperazino]-(2-pyridyl)methanone Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=N4

Isomeric SMILES

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=N4

InChI

InChI=1S/C21H21N5O2S/c1-29-21-23-15-18(26(21)16-7-3-2-4-8-16)20(28)25-13-11-24(12-14-25)19(27)17-9-5-6-10-22-17/h2-10,15H,11-14H2,1H3