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

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

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

InChI

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