N-[2-[3-(phenylmethyl)-7-sulfanyl-naphthalen-1-yl]ethyl]cyclohexanecarboxamide

Systemtic Name: N-[2-[3-(phenylmethyl)-7-sulfanyl-naphthalen-1-yl]ethyl]cyclohexanecarboxamide Openeye Name: N-[2-(3-benzyl-7-sulfanyl-1-naphthyl)ethyl]cyclohexanecarboxamide CAS Name: N-[2-[7-mercapto-3-(phenylmethyl)-1-naphthalenyl]ethyl]cyclohexanecarboxamide IUPAC Name: N-[2-(3-benzyl-7-sulfanylnaphthalen-1-yl)ethyl]cyclohexanecarboxamide Traditional Name: N-[2-(3-benzyl-7-mercapto-1-naphthyl)ethyl]cyclohexanecarboxamide Formula: C26H29NOS MolecularWeight: 403.57956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NCCC2=C3C=C(C=CC3=CC(=C2)CC4=CC=CC=C4)S

Isomeric SMILES

C1CCC(CC1)C(=O)NCCC2=C3C=C(C=CC3=CC(=C2)CC4=CC=CC=C4)S

InChI

InChI=1S/C26H29NOS/c28-26(21-9-5-2-6-10-21)27-14-13-23-17-20(15-19-7-3-1-4-8-19)16-22-11-12-24(29)18-25(22)23/h1,3-4,7-8,11-12,16-18,21,29H,2,5-6,9-10,13-15H2,(H,27,28)