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

Systemtic Name: ethyl 2-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-3-methyl-1-(4-pyridin-2-ylphenyl)carbonyl-piperazin-2-yl]methylsulfamoyl]ethanoate Openeye Name: ethyl 2-[[4-[(6-chloro-2-naphthyl)sulfonyl]-3-methyl-1-[4-(2-pyridyl)benzoyl]piperazin-2-yl]methylsulfamoyl]acetate CAS Name: 2-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-3-methyl-1-[oxo-[4-(2-pyridinyl)phenyl]methyl]-2-piperazinyl]methylsulfamoyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(6-chloronaphthalen-2-yl)sulfonyl-3-methyl-1-(4-pyridin-2-ylbenzoyl)piperazin-2-yl]methylsulfamoyl]acetate Traditional Name: 2-[[4-[(6-chloro-2-naphthyl)sulfonyl]-3-methyl-1-[4-(2-pyridyl)benzoyl]piperazin-2-yl]methylsulfamoyl]acetic acid ethyl ester Formula: C32H33ClN4O7S2 MolecularWeight: 685.21002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)NCC1C(N(CCN1C(=O)C2=CC=C(C=C2)C3=CC=CC=N3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)C

Isomeric SMILES

CCOC(=O)CS(=O)(=O)NCC1C(N(CCN1C(=O)C2=CC=C(C=C2)C3=CC=CC=N3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)C

InChI

InChI=1S/C32H33ClN4O7S2/c1-3-44-31(38)21-45(40,41)35-20-30-22(2)37(46(42,43)28-14-12-25-18-27(33)13-11-26(25)19-28)17-16-36(30)32(39)24-9-7-23(8-10-24)29-6-4-5-15-34-29/h4-15,18-19,22,30,35H,3,16-17,20-21H2,1-2H3