N-[2-(4-aminophenyl)ethyl]-4-pentoxy-3-pentyl-benzenecarbothioamide

Systemtic Name: N-[2-(4-aminophenyl)ethyl]-4-pentoxy-3-pentyl-benzenecarbothioamide Openeye Name: N-[2-(4-aminophenyl)ethyl]-4-pentoxy-3-pentyl-benzenecarbothioamide CAS Name: N-[2-(4-aminophenyl)ethyl]-4-pentoxy-3-pentylbenzenecarbothioamide IUPAC Name: N-[2-(4-aminophenyl)ethyl]-4-pentoxy-3-pentylbenzenecarbothioamide Traditional Name: N-[2-(4-aminophenyl)ethyl]-4-amoxy-3-amyl-thiobenzamide Formula: C25H36N2OS MolecularWeight: 412.63114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1)C(=S)NCCC2=CC=C(C=C2)N)OCCCCC

Isomeric SMILES

CCCCCC1=C(C=CC(=C1)C(=S)NCCC2=CC=C(C=C2)N)OCCCCC

InChI

InChI=1S/C25H36N2OS/c1-3-5-7-9-21-19-22(12-15-24(21)28-18-8-6-4-2)25(29)27-17-16-20-10-13-23(26)14-11-20/h10-15,19H,3-9,16-18,26H2,1-2H3,(H,27,29)