tert-butyl N-[[7-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonylnaphthalen-2-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[7-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonylnaphthalen-2-yl]methyl]carbamate Openeye Name: tert-butyl N-[[7-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]-2-naphthyl]methyl]carbamate CAS Name: N-[[7-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-piperazinyl]-oxomethyl]-2-naphthalenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[7-[4-(6-chloronaphthalen-2-yl)sulfonylpiperazine-1-carbonyl]naphthalen-2-yl]methyl]carbamate Traditional Name: N-[[7-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]-2-naphthyl]methyl]carbamic acid tert-butyl ester Formula: C31H32ClN3O5S MolecularWeight: 594.12088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC2=C(C=C1)C=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC2=C(C=C1)C=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C31H32ClN3O5S/c1-31(2,3)40-30(37)33-20-21-4-5-22-6-7-25(17-26(22)16-21)29(36)34-12-14-35(15-13-34)41(38,39)28-11-9-23-18-27(32)10-8-24(23)19-28/h4-11,16-19H,12-15,20H2,1-3H3,(H,33,37)