[4-(6-chloranylnaphthalen-2-yl)sulfonyl-3,3-dimethyl-piperazin-1-yl]-(4-pyridin-4-ylphenyl)methanone

Systemtic Name: [4-(6-chloranylnaphthalen-2-yl)sulfonyl-3,3-dimethyl-piperazin-1-yl]-(4-pyridin-4-ylphenyl)methanone Openeye Name: [4-[(6-chloro-2-naphthyl)sulfonyl]-3,3-dimethyl-piperazin-1-yl]-[4-(4-pyridyl)phenyl]methanone CAS Name: [4-[(6-chloro-2-naphthalenyl)sulfonyl]-3,3-dimethyl-1-piperazinyl]-(4-pyridin-4-ylphenyl)methanone IUPAC Name: [4-(6-chloronaphthalen-2-yl)sulfonyl-3,3-dimethylpiperazin-1-yl]-(4-pyridin-4-ylphenyl)methanone Traditional Name: [4-[(6-chloro-2-naphthyl)sulfonyl]-3,3-dimethyl-piperazino]-[4-(4-pyridyl)phenyl]methanone Formula: C28H26ClN3O3S MolecularWeight: 520.04234

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)C5=CC=NC=C5)C

Isomeric SMILES

CC1(CN(CCN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)C5=CC=NC=C5)C

InChI

InChI=1S/C28H26ClN3O3S/c1-28(2)19-31(27(33)22-5-3-20(4-6-22)21-11-13-30-14-12-21)15-16-32(28)36(34,35)26-10-8-23-17-25(29)9-7-24(23)18-26/h3-14,17-18H,15-16,19H2,1-2H3