N5-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-N2-propan-2-yl-1,3,4-thiadiazole-2,5-diamine

Systemtic Name: N5-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-N2-propan-2-yl-1,3,4-thiadiazole-2,5-diamine Openeye Name: N2-isopropyl-N5-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-1,3,4-thiadiazole-2,5-diamine CAS Name: N5-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-N2-propan-2-yl-1,3,4-thiadiazole-2,5-diamine IUPAC Name: 5-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-2-N-propan-2-yl-1,3,4-thiadiazole-2,5-diamine Traditional Name: isopropyl-[5-[3-[3-(piperidinomethyl)phenoxy]propylamino]-1,3,4-thiadiazol-2-yl]amine Formula: C20H31N5OS MolecularWeight: 389.55804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NN=C(S1)NCCCOC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

CC(C)NC1=NN=C(S1)NCCCOC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C20H31N5OS/c1-16(2)22-20-24-23-19(27-20)21-10-7-13-26-18-9-6-8-17(14-18)15-25-11-4-3-5-12-25/h6,8-9,14,16H,3-5,7,10-13,15H2,1-2H3,(H,21,23)(H,22,24)