3-[2-(3,4-diethoxyphenyl)ethyl]-1-(furan-2-ylmethyl)-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1-(furan-2-ylmethyl)-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1-(2-furylmethyl)-1-(2-pyridylmethyl)thiourea CAS Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1-(2-furanylmethyl)-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1-(furan-2-ylmethyl)-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1-(2-furfuryl)-1-(2-pyridylmethyl)thiourea Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=S)N(CC2=CC=CC=N2)CC3=CC=CO3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=S)N(CC2=CC=CC=N2)CC3=CC=CO3)OCC

InChI

InChI=1S/C24H29N3O3S/c1-3-28-22-11-10-19(16-23(22)29-4-2)12-14-26-24(31)27(18-21-9-7-15-30-21)17-20-8-5-6-13-25-20/h5-11,13,15-16H,3-4,12,14,17-18H2,1-2H3,(H,26,31)