methyl N-[2-[1-(4-methylphenyl)sulfonylindol-3-yl]-1-phenylselanyl-ethyl]carbamate

Systemtic Name: methyl N-[2-[1-(4-methylphenyl)sulfonylindol-3-yl]-1-phenylselanyl-ethyl]carbamate Openeye Name: methyl N-[1-phenylselanyl-2-[1-(p-tolylsulfonyl)indol-3-yl]ethyl]carbamate CAS Name: N-[2-[1-(4-methylphenyl)sulfonyl-3-indolyl]-1-(phenylseleno)ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[1-(4-methylphenyl)sulfonylindol-3-yl]-1-phenylselanylethyl]carbamate Traditional Name: N-[1-(phenylseleno)-2-(1-tosylindol-3-yl)ethyl]carbamic acid methyl ester Formula: C25H24N2O4SSe MolecularWeight: 527.49406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC(NC(=O)OC)[Se]C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC(NC(=O)OC)[Se]C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O4SSe/c1-18-12-14-20(15-13-18)32(29,30)27-17-19(22-10-6-7-11-23(22)27)16-24(26-25(28)31-2)33-21-8-4-3-5-9-21/h3-15,17,24H,16H2,1-2H3,(H,26,28)