[4-(4-azanyl-5-sulfanyl-pentoxy)phenyl]-phenyl-methanone

Systemtic Name: [4-(4-azanyl-5-sulfanyl-pentoxy)phenyl]-phenyl-methanone Openeye Name: [4-(4-amino-5-sulfanyl-pentoxy)phenyl]-phenyl-methanone CAS Name: [4-(4-amino-5-mercaptopentoxy)phenyl]-phenylmethanone IUPAC Name: [4-(4-amino-5-sulfanylpentoxy)phenyl]-phenylmethanone Traditional Name: [4-(4-amino-5-mercapto-pentoxy)phenyl]-phenyl-methanone Formula: C18H21NO2S MolecularWeight: 315.42984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCCCC(CS)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCCCC(CS)N

InChI

InChI=1S/C18H21NO2S/c19-16(13-22)7-4-12-21-17-10-8-15(9-11-17)18(20)14-5-2-1-3-6-14/h1-3,5-6,8-11,16,22H,4,7,12-13,19H2