7-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]naphthalene-2-carbonitrile

Systemtic Name: 7-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]naphthalene-2-carbonitrile Openeye Name: 7-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-oxo-piperazin-1-yl]methyl]naphthalene-2-carbonitrile CAS Name: 7-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-oxo-1-piperazinyl]methyl]-2-naphthalenecarbonitrile IUPAC Name: 7-[[4-(6-chloronaphthalen-2-yl)sulfonyl-2-oxopiperazin-1-yl]methyl]naphthalene-2-carbonitrile Traditional Name: 7-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-keto-piperazino]methyl]naphthalene-2-carbonitrile Formula: C26H20ClN3O3S MolecularWeight: 489.9733

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC4=CC5=C(C=C4)C=CC(=C5)C#N

Isomeric SMILES

C1CN(C(=O)CN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC4=CC5=C(C=C4)C=CC(=C5)C#N

InChI

InChI=1S/C26H20ClN3O3S/c27-24-7-5-22-14-25(8-6-21(22)13-24)34(32,33)30-10-9-29(26(31)17-30)16-19-2-4-20-3-1-18(15-28)11-23(20)12-19/h1-8,11-14H,9-10,16-17H2