N-[[3-[(pentanethioylamino)methyl]phenyl]methyl]pentanethioamide

Systemtic Name: N-[[3-[(pentanethioylamino)methyl]phenyl]methyl]pentanethioamide Openeye Name: N-[[3-[(pentanethioylamino)methyl]phenyl]methyl]pentanethioamide CAS Name: N-[[3-[(1-sulfanylidenepentylamino)methyl]phenyl]methyl]pentanethioamide IUPAC Name: N-[[3-[(pentanethioylamino)methyl]phenyl]methyl]pentanethioamide Traditional Name: N-[3-[(pentanethioylamino)methyl]benzyl]thiovaleramide Formula: C18H28N2S2 MolecularWeight: 336.55832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=S)NCC1=CC(=CC=C1)CNC(=S)CCCC

Isomeric SMILES

CCCCC(=S)NCC1=CC(=CC=C1)CNC(=S)CCCC

InChI

InChI=1S/C18H28N2S2/c1-3-5-10-17(21)19-13-15-8-7-9-16(12-15)14-20-18(22)11-6-4-2/h7-9,12H,3-6,10-11,13-14H2,1-2H3,(H,19,21)(H,20,22)