2-[bis[(4-bromophenyl)sulfanyl]phosphinothioylmethyl-phenylmethoxycarbonyl-amino]-4-chloranyl-butanoic acid

Systemtic Name: 2-[bis[(4-bromophenyl)sulfanyl]phosphinothioylmethyl-phenylmethoxycarbonyl-amino]-4-chloranyl-butanoic acid Openeye Name: 2-[benzyloxycarbonyl-[bis[(4-bromophenyl)sulfanyl]phosphinothioylmethyl]amino]-4-chloro-butanoic acid CAS Name: 2-[bis[(4-bromophenyl)thio]phosphinothioylmethyl-phenylmethoxycarbonylamino]-4-chlorobutanoic acid IUPAC Name: 2-[bis[(4-bromophenyl)sulfanyl]phosphinothioylmethyl-phenylmethoxycarbonylamino]-4-chlorobutanoic acid Traditional Name: 2-[bis[(4-bromophenyl)thio]thiophosphorylmethyl-carbobenzoxy-amino]-4-chloro-butyric acid Formula: C25H23Br2ClNO4PS3 MolecularWeight: 723.884181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(CP(=S)(SC2=CC=C(C=C2)Br)SC3=CC=C(C=C3)Br)C(CCCl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(CP(=S)(SC2=CC=C(C=C2)Br)SC3=CC=C(C=C3)Br)C(CCCl)C(=O)O

InChI

InChI=1S/C25H23Br2ClNO4PS3/c26-19-6-10-21(11-7-19)36-34(35,37-22-12-8-20(27)9-13-22)17-29(23(14-15-28)24(30)31)25(32)33-16-18-4-2-1-3-5-18/h1-13,23H,14-17H2,(H,30,31)