1-[2-(2,6-dimethoxyphenyl)ethyl]-3-(4-fluoranyl-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-[2-(2,6-dimethoxyphenyl)ethyl]-3-(4-fluoranyl-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-[2-(2,6-dimethoxyphenyl)ethyl]-3-(4-fluoro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-[2-(2,6-dimethoxyphenyl)ethyl]-3-(4-fluoro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-[2-(2,6-dimethoxyphenyl)ethyl]-3-(4-fluoro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-[2-(2,6-dimethoxyphenyl)ethyl]-3-(4-fluoro-1,3-benzothiazol-2-yl)thiourea Formula: C18H18FN3O2S2 MolecularWeight: 391.482823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)CCNC(=S)NC2=NC3=C(C=CC=C3S2)F

Isomeric SMILES

COC1=C(C(=CC=C1)OC)CCNC(=S)NC2=NC3=C(C=CC=C3S2)F

InChI

InChI=1S/C18H18FN3O2S2/c1-23-13-6-4-7-14(24-2)11(13)9-10-20-17(25)22-18-21-16-12(19)5-3-8-15(16)26-18/h3-8H,9-10H2,1-2H3,(H2,20,21,22,25)