tert-butyl N-[[1,1-bis(oxidanylidene)-3-phenylsulfanyl-2,3-dihydro-1-benzothiophen-4-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[1,1-bis(oxidanylidene)-3-phenylsulfanyl-2,3-dihydro-1-benzothiophen-4-yl]methyl]carbamate Openeye Name: tert-butyl N-[(1,1-dioxo-3-phenylsulfanyl-2,3-dihydrobenzothiophen-4-yl)methyl]carbamate CAS Name: N-[[1,1-dioxo-3-(phenylthio)-2,3-dihydro-1-benzothiophen-4-yl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1,1-dioxo-3-phenylsulfanyl-2,3-dihydro-1-benzothiophen-4-yl)methyl]carbamate Traditional Name: N-[[1,1-diketo-3-(phenylthio)-2,3-dihydrobenzothiophen-4-yl]methyl]carbamic acid tert-butyl ester Formula: C20H23NO4S2 MolecularWeight: 405.53092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=C2C(CS(=O)(=O)C2=CC=C1)SC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=C2C(CS(=O)(=O)C2=CC=C1)SC3=CC=CC=C3

InChI

InChI=1S/C20H23NO4S2/c1-20(2,3)25-19(22)21-12-14-8-7-11-17-18(14)16(13-27(17,23)24)26-15-9-5-4-6-10-15/h4-11,16H,12-13H2,1-3H3,(H,21,22)