[3-(4-bromophenyl)-5,7-bis(sulfanylmethyl)-1-adamantyl]methanethiol

Systemtic Name: [3-(4-bromophenyl)-5,7-bis(sulfanylmethyl)-1-adamantyl]methanethiol Openeye Name: [3-(4-bromophenyl)-5,7-bis(sulfanylmethyl)-1-adamantyl]methanethiol CAS Name: [3-(4-bromophenyl)-5,7-bis(mercaptomethyl)-1-adamantyl]methanethiol IUPAC Name: [3-(4-bromophenyl)-5,7-bis(sulfanylmethyl)-1-adamantyl]methanethiol Traditional Name: [3-(4-bromophenyl)-5,7-bis(mercaptomethyl)-1-adamantyl]methanethiol Formula: C19H25BrS3 MolecularWeight: 429.5008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2(CC3(CC1(CC(C2)(C3)C4=CC=C(C=C4)Br)CS)CS)CS

Isomeric SMILES

C1C2(CC3(CC1(CC(C2)(C3)C4=CC=C(C=C4)Br)CS)CS)CS

InChI

InChI=1S/C19H25BrS3/c20-15-3-1-14(2-4-15)19-8-16(11-21)5-17(9-19,12-22)7-18(6-16,10-19)13-23/h1-4,21-23H,5-13H2