4-[4-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2,6-dimethyl-piperazin-1-yl]carbonylphenyl]pyridine-2-carbonitrile

Systemtic Name: 4-[4-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2,6-dimethyl-piperazin-1-yl]carbonylphenyl]pyridine-2-carbonitrile Openeye Name: 4-[4-[4-[(6-chloro-2-naphthyl)sulfonyl]-2,6-dimethyl-piperazine-1-carbonyl]phenyl]pyridine-2-carbonitrile CAS Name: 4-[4-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2,6-dimethyl-1-piperazinyl]-oxomethyl]phenyl]-2-pyridinecarbonitrile IUPAC Name: 4-[4-[4-(6-chloronaphthalen-2-yl)sulfonyl-2,6-dimethylpiperazine-1-carbonyl]phenyl]pyridine-2-carbonitrile Traditional Name: 4-[4-[4-[(6-chloro-2-naphthyl)sulfonyl]-2,6-dimethyl-piperazine-1-carbonyl]phenyl]picolinonitrile Formula: C29H25ClN4O3S MolecularWeight: 545.0518

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C(=O)C2=CC=C(C=C2)C3=CC(=NC=C3)C#N)C)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

CC1CN(CC(N1C(=O)C2=CC=C(C=C2)C3=CC(=NC=C3)C#N)C)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C29H25ClN4O3S/c1-19-17-33(38(36,37)28-10-8-23-13-26(30)9-7-24(23)15-28)18-20(2)34(19)29(35)22-5-3-21(4-6-22)25-11-12-32-27(14-25)16-31/h3-15,19-20H,17-18H2,1-2H3