1-(furan-2-ylmethyl)-1-(1-methylpiperidin-4-yl)-3-octan-3-yl-thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-1-(1-methylpiperidin-4-yl)-3-octan-3-yl-thiourea Openeye Name: 3-(1-ethylhexyl)-1-(2-furylmethyl)-1-(1-methyl-4-piperidyl)thiourea CAS Name: 1-(2-furanylmethyl)-1-(1-methyl-4-piperidinyl)-3-octan-3-ylthiourea IUPAC Name: 1-(furan-2-ylmethyl)-1-(1-methylpiperidin-4-yl)-3-octan-3-ylthiourea Traditional Name: 3-(1-ethylhexyl)-1-(2-furfuryl)-1-(1-methyl-4-piperidyl)thiourea Formula: C20H35N3OS MolecularWeight: 365.5764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NC(=S)N(CC1=CC=CO1)C2CCN(CC2)C

Isomeric SMILES

CCCCCC(CC)NC(=S)N(CC1=CC=CO1)C2CCN(CC2)C

InChI

InChI=1S/C20H35N3OS/c1-4-6-7-9-17(5-2)21-20(25)23(16-19-10-8-15-24-19)18-11-13-22(3)14-12-18/h8,10,15,17-18H,4-7,9,11-14,16H2,1-3H3,(H,21,25)