3-[3-[2-[3-[2-[methyl-[4-(2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)butyl]amino]ethanoylamino]propoxy]ethoxy]propylamino]propanamide

Systemtic Name: 3-[3-[2-[3-[2-[methyl-[4-(2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)butyl]amino]ethanoylamino]propoxy]ethoxy]propylamino]propanamide Openeye Name: 3-[3-[2-[3-[[2-[methyl-[4-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)butyl]amino]acetyl]amino]propoxy]ethoxy]propylamino]propanamide CAS Name: 3-[3-[2-[3-[[2-[methyl-[4-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)butyl]amino]-1-oxoethyl]amino]propoxy]ethoxy]propylamino]propanamide IUPAC Name: 3-[3-[2-[3-[[2-[methyl-[4-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)butyl]amino]acetyl]amino]propoxy]ethoxy]propylamino]propanamide Traditional Name: 3-[3-[2-[3-[[2-[4-(2-keto-1,3,3a,4,6,6a-hexahydrothien[3,4-d]imidazol-4-yl)butyl-methyl-amino]acetyl]amino]propoxy]ethoxy]propylamino]propionamide Formula: C23H44N6O5S MolecularWeight: 516.69766

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC1C2C(CS1)NC(=O)N2)CC(=O)NCCCOCCOCCCNCCC(=O)N

Isomeric SMILES

CN(CCCCC1C2C(CS1)NC(=O)N2)CC(=O)NCCCOCCOCCCNCCC(=O)N

InChI

InChI=1S/C23H44N6O5S/c1-29(11-3-2-6-19-22-18(17-35-19)27-23(32)28-22)16-21(31)26-9-5-13-34-15-14-33-12-4-8-25-10-7-20(24)30/h18-19,22,25H,2-17H2,1H3,(H2,24,30)(H,26,31)(H2,27,28,32)