N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-4-(thiophen-2-ylmethylcarbamothioylamino)butanamide

Systemtic Name: N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-4-(thiophen-2-ylmethylcarbamothioylamino)butanamide Openeye Name: N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-4-(2-thienylmethylcarbamothioylamino)butanamide CAS Name: N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-4-[[sulfanylidene-(thiophen-2-ylmethylamino)methyl]amino]butanamide IUPAC Name: N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-4-(thiophen-2-ylmethylcarbamothioylamino)butanamide Traditional Name: N-[3-[3-(piperidinomethyl)phenoxy]propyl]-4-(2-thenylthiocarbamoylamino)butyramide Formula: C25H36N4O2S2 MolecularWeight: 488.70894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CCCNC(=S)NCC3=CC=CS3

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CCCNC(=S)NCC3=CC=CS3

InChI

InChI=1S/C25H36N4O2S2/c30-24(11-5-12-27-25(32)28-19-23-10-6-17-33-23)26-13-7-16-31-22-9-4-8-21(18-22)20-29-14-2-1-3-15-29/h4,6,8-10,17-18H,1-3,5,7,11-16,19-20H2,(H,26,30)(H2,27,28,32)