3-(2,6-diethylphenyl)-1-(furan-2-ylmethyl)-1-(1-methylpiperidin-4-yl)thiourea

Systemtic Name: 3-(2,6-diethylphenyl)-1-(furan-2-ylmethyl)-1-(1-methylpiperidin-4-yl)thiourea Openeye Name: 3-(2,6-diethylphenyl)-1-(2-furylmethyl)-1-(1-methyl-4-piperidyl)thiourea CAS Name: 3-(2,6-diethylphenyl)-1-(2-furanylmethyl)-1-(1-methyl-4-piperidinyl)thiourea IUPAC Name: 3-(2,6-diethylphenyl)-1-(furan-2-ylmethyl)-1-(1-methylpiperidin-4-yl)thiourea Traditional Name: 3-(2,6-diethylphenyl)-1-(2-furfuryl)-1-(1-methyl-4-piperidyl)thiourea Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N(CC2=CC=CO2)C3CCN(CC3)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N(CC2=CC=CO2)C3CCN(CC3)C

InChI

InChI=1S/C22H31N3OS/c1-4-17-8-6-9-18(5-2)21(17)23-22(27)25(16-20-10-7-15-26-20)19-11-13-24(3)14-12-19/h6-10,15,19H,4-5,11-14,16H2,1-3H3,(H,23,27)