N-methyl-1-[[5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]furan-2-yl]methyl]-N-phenethyl-piperidin-3-amine

Systemtic Name: N-methyl-1-[[5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]furan-2-yl]methyl]-N-phenethyl-piperidin-3-amine Openeye Name: N-methyl-1-[[5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-furyl]methyl]-N-phenethyl-piperidin-3-amine CAS Name: N-methyl-1-[[5-[(4-methyl-1,2,4-triazol-3-yl)thio]-2-furanyl]methyl]-N-phenethyl-3-piperidinamine IUPAC Name: N-methyl-1-[[5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]furan-2-yl]methyl]-N-phenethylpiperidin-3-amine Traditional Name: methyl-[1-[[5-[(4-methyl-1,2,4-triazol-3-yl)thio]-2-furyl]methyl]-3-piperidyl]-phenethyl-amine Formula: C22H29N5OS MolecularWeight: 411.56356

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=CC=C(O2)CN3CCCC(C3)N(C)CCC4=CC=CC=C4

Isomeric SMILES

CN1C=NN=C1SC2=CC=C(O2)CN3CCCC(C3)N(C)CCC4=CC=CC=C4

InChI

InChI=1S/C22H29N5OS/c1-25(14-12-18-7-4-3-5-8-18)19-9-6-13-27(15-19)16-20-10-11-21(28-20)29-22-24-23-17-26(22)2/h3-5,7-8,10-11,17,19H,6,9,12-16H2,1-2H3