5-(phenylmethyl)-1,9-dithia-5,13-diazacyclohexadecane

Systemtic Name: 5-(phenylmethyl)-1,9-dithia-5,13-diazacyclohexadecane Openeye Name: 5-benzyl-1,9-dithia-5,13-diazacyclohexadecane CAS Name: 5-(phenylmethyl)-1,9-dithia-5,13-diazacyclohexadecane IUPAC Name: 5-benzyl-1,9-dithia-5,13-diazacyclohexadecane Traditional Name: 5-benzyl-1,9-dithia-5,13-diazacyclohexadecane Formula: C19H32N2S2 MolecularWeight: 352.60078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCCSCCCN(CCCSC1)CC2=CC=CC=C2

Isomeric SMILES

C1CNCCCSCCCN(CCCSC1)CC2=CC=CC=C2

InChI

InChI=1S/C19H32N2S2/c1-2-8-19(9-3-1)18-21-12-6-16-22-14-4-10-20-11-5-15-23-17-7-13-21/h1-3,8-9,20H,4-7,10-18H2