2-methyl-3-[[5-(4-methylpiperidin-1-yl)-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline

Systemtic Name: 2-methyl-3-[[5-(4-methylpiperidin-1-yl)-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline Openeye Name: 2-methyl-3-[[5-(4-methyl-1-piperidyl)-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline CAS Name: 2-methyl-3-[[[5-(4-methyl-1-piperidinyl)-4-(2-oxolanylmethyl)-1,2,4-triazol-3-yl]thio]methyl]quinoxaline IUPAC Name: 2-methyl-3-[[5-(4-methylpiperidin-1-yl)-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline Traditional Name: 2-methyl-3-[[[5-(4-methylpiperidino)-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]methyl]quinoxaline Formula: C23H30N6OS MolecularWeight: 438.5889

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(N2CC3CCCO3)SCC4=NC5=CC=CC=C5N=C4C

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(N2CC3CCCO3)SCC4=NC5=CC=CC=C5N=C4C

InChI

InChI=1S/C23H30N6OS/c1-16-9-11-28(12-10-16)22-26-27-23(29(22)14-18-6-5-13-30-18)31-15-21-17(2)24-19-7-3-4-8-20(19)25-21/h3-4,7-8,16,18H,5-6,9-15H2,1-2H3