S-(phenylmethyl) 5-[3-(methylamino)-5-phenyl-thiophen-2-yl]pentanethioate

Systemtic Name: S-(phenylmethyl) 5-[3-(methylamino)-5-phenyl-thiophen-2-yl]pentanethioate Openeye Name: S-benzyl 5-[3-(methylamino)-5-phenyl-2-thienyl]pentanethioate CAS Name: 5-[3-(methylamino)-5-phenyl-2-thiophenyl]pentanethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl 5-[3-(methylamino)-5-phenylthiophen-2-yl]pentanethioate Traditional Name: 5-[3-(methylamino)-5-phenyl-2-thienyl]pentanethioic acid S-benzyl ester Formula: C23H25NOS2 MolecularWeight: 395.5807

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(SC(=C1)C2=CC=CC=C2)CCCCC(=O)SCC3=CC=CC=C3

Isomeric SMILES

CNC1=C(SC(=C1)C2=CC=CC=C2)CCCCC(=O)SCC3=CC=CC=C3

InChI

InChI=1S/C23H25NOS2/c1-24-20-16-22(19-12-6-3-7-13-19)27-21(20)14-8-9-15-23(25)26-17-18-10-4-2-5-11-18/h2-7,10-13,16,24H,8-9,14-15,17H2,1H3