tert-butyl N-[[4-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonylphenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonylphenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-piperazinyl]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[4-(6-chloronaphthalen-2-yl)sulfonylpiperazine-1-carbonyl]phenyl]methyl]carbamate Traditional Name: N-[4-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]benzyl]carbamic acid tert-butyl ester Formula: C27H30ClN3O5S MolecularWeight: 544.0622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C27H30ClN3O5S/c1-27(2,3)36-26(33)29-18-19-4-6-20(7-5-19)25(32)30-12-14-31(15-13-30)37(34,35)24-11-9-21-16-23(28)10-8-22(21)17-24/h4-11,16-17H,12-15,18H2,1-3H3,(H,29,33)