2-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-3-methyl-1-(4-pyridin-4-ylphenyl)carbonyl-piperazin-2-yl]ethanamide

Systemtic Name: 2-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-3-methyl-1-(4-pyridin-4-ylphenyl)carbonyl-piperazin-2-yl]ethanamide Openeye Name: 2-[4-[(6-chloro-2-naphthyl)sulfonyl]-3-methyl-1-[4-(4-pyridyl)benzoyl]piperazin-2-yl]acetamide CAS Name: 2-[4-[(6-chloro-2-naphthalenyl)sulfonyl]-3-methyl-1-[oxo-(4-pyridin-4-ylphenyl)methyl]-2-piperazinyl]acetamide IUPAC Name: 2-[4-(6-chloronaphthalen-2-yl)sulfonyl-3-methyl-1-(4-pyridin-4-ylbenzoyl)piperazin-2-yl]acetamide Traditional Name: 2-[4-[(6-chloro-2-naphthyl)sulfonyl]-3-methyl-1-[4-(4-pyridyl)benzoyl]piperazin-2-yl]acetamide Formula: C29H27ClN4O4S MolecularWeight: 563.06708

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(CCN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)C5=CC=NC=C5)CC(=O)N

Isomeric SMILES

CC1C(N(CCN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)C5=CC=NC=C5)CC(=O)N

InChI

InChI=1S/C29H27ClN4O4S/c1-19-27(18-28(31)35)33(29(36)22-4-2-20(3-5-22)21-10-12-32-13-11-21)14-15-34(19)39(37,38)26-9-7-23-16-25(30)8-6-24(23)17-26/h2-13,16-17,19,27H,14-15,18H2,1H3,(H2,31,35)