1-(1,3-benzothiazol-2-yl)-3-[2-(2-fluoranyl-6-methoxy-phenyl)ethyl]thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(2-fluoranyl-6-methoxy-phenyl)ethyl]thiourea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(2-fluoro-6-methoxy-phenyl)ethyl]thiourea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(2-fluoro-6-methoxyphenyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(2-fluoro-6-methoxyphenyl)ethyl]thiourea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(2-fluoro-6-methoxy-phenyl)ethyl]thiourea Formula: C17H16FN3OS2 MolecularWeight: 361.456843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FN3OS2/c1-22-14-7-4-5-12(18)11(14)9-10-19-16(23)21-17-20-13-6-2-3-8-15(13)24-17/h2-8H,9-10H2,1H3,(H2,19,20,21,23)