3-(2,6-dimethylphenyl)-1-[3-(4-ethylpiperazin-1-yl)propyl]-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 3-(2,6-dimethylphenyl)-1-[3-(4-ethylpiperazin-1-yl)propyl]-1-(furan-2-ylmethyl)thiourea Openeye Name: 3-(2,6-dimethylphenyl)-1-[3-(4-ethylpiperazin-1-yl)propyl]-1-(2-furylmethyl)thiourea CAS Name: 3-(2,6-dimethylphenyl)-1-[3-(4-ethyl-1-piperazinyl)propyl]-1-(2-furanylmethyl)thiourea IUPAC Name: 3-(2,6-dimethylphenyl)-1-[3-(4-ethylpiperazin-1-yl)propyl]-1-(furan-2-ylmethyl)thiourea Traditional Name: 3-(2,6-dimethylphenyl)-1-[3-(4-ethylpiperazino)propyl]-1-(2-furfuryl)thiourea Formula: C23H34N4OS MolecularWeight: 414.60726

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCN(CC2=CC=CO2)C(=S)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCN1CCN(CC1)CCCN(CC2=CC=CO2)C(=S)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C23H34N4OS/c1-4-25-13-15-26(16-14-25)11-7-12-27(18-21-10-6-17-28-21)23(29)24-22-19(2)8-5-9-20(22)3/h5-6,8-10,17H,4,7,11-16,18H2,1-3H3,(H,24,29)