tert-butyl N-[[4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonylphenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonylphenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)phenyl]methyl]carbamate CAS Name: N-[[4-[[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazine-1-carbonyl]phenyl]methyl]carbamate Traditional Name: N-[4-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)benzyl]carbamic acid tert-butyl ester Formula: C26H33N3O5S MolecularWeight: 499.62232

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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(CCC4)C=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C26H33N3O5S/c1-26(2,3)34-25(31)27-18-19-7-9-21(10-8-19)24(30)28-13-15-29(16-14-28)35(32,33)23-12-11-20-5-4-6-22(20)17-23/h7-12,17H,4-6,13-16,18H2,1-3H3,(H,27,31)