5-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-yl]-2-(2-furyl)oxazole-4-carbonitrile CAS Name: 5-[4-(4-bromo-2-chlorophenyl)sulfonyl-1-piperazinyl]-2-(2-furanyl)-4-oxazolecarbonitrile IUPAC Name: 5-[4-(4-bromo-2-chlorophenyl)sulfonylpiperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazino]-2-(2-furyl)oxazole-4-carbonitrile Formula: C18H14BrClN4O4S MolecularWeight: 497.75016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(N=C(O2)C3=CC=CO3)C#N)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1CN(CCN1C2=C(N=C(O2)C3=CC=CO3)C#N)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C18H14BrClN4O4S/c19-12-3-4-16(13(20)10-12)29(25,26)24-7-5-23(6-8-24)18-14(11-21)22-17(28-18)15-2-1-9-27-15/h1-4,9-10H,5-8H2