4-[4-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonylphenyl]pyridine-2-carbonitrile

Systemtic Name: 4-[4-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonylphenyl]pyridine-2-carbonitrile Openeye Name: 4-[4-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]phenyl]pyridine-2-carbonitrile CAS Name: 4-[4-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-piperazinyl]-oxomethyl]phenyl]-2-pyridinecarbonitrile IUPAC Name: 4-[4-[4-(6-chloronaphthalen-2-yl)sulfonylpiperazine-1-carbonyl]phenyl]pyridine-2-carbonitrile Traditional Name: 4-[4-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]phenyl]picolinonitrile Formula: C27H21ClN4O3S MolecularWeight: 516.99864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=CC(=NC=C3)C#N)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=CC(=NC=C3)C#N)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C27H21ClN4O3S/c28-24-7-5-22-17-26(8-6-21(22)15-24)36(34,35)32-13-11-31(12-14-32)27(33)20-3-1-19(2-4-20)23-9-10-30-25(16-23)18-29/h1-10,15-17H,11-14H2