5-[4-(6-chloranylpyridin-3-yl)carbonylpiperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(6-chloranylpyridin-3-yl)carbonylpiperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(6-chloropyridine-3-carbonyl)piperazin-1-yl]-2-cyclopropyl-oxazole-4-carbonitrile CAS Name: 5-[4-[(6-chloro-3-pyridinyl)-oxomethyl]-1-piperazinyl]-2-cyclopropyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-(6-chloropyridine-3-carbonyl)piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(6-chloronicotinoyl)piperazino]-2-cyclopropyl-oxazole-4-carbonitrile Formula: C17H16ClN5O2 MolecularWeight: 357.79424

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CN=C(C=C4)Cl)C#N

Isomeric SMILES

C1CC1C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CN=C(C=C4)Cl)C#N

InChI

InChI=1S/C17H16ClN5O2/c18-14-4-3-12(10-20-14)16(24)22-5-7-23(8-6-22)17-13(9-19)21-15(25-17)11-1-2-11/h3-4,10-11H,1-2,5-8H2