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

Systemtic Name: 1-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-[2-(3-methoxyphenyl)ethyl]thiourea Openeye Name: 1-(4-fluoro-1,3-benzothiazol-2-yl)-3-[2-(3-methoxyphenyl)ethyl]thiourea CAS Name: 1-(4-fluoro-1,3-benzothiazol-2-yl)-3-[2-(3-methoxyphenyl)ethyl]thiourea IUPAC Name: 1-(4-fluoro-1,3-benzothiazol-2-yl)-3-[2-(3-methoxyphenyl)ethyl]thiourea Traditional Name: 1-(4-fluoro-1,3-benzothiazol-2-yl)-3-[2-(3-methoxyphenyl)ethyl]thiourea Formula: C17H16FN3OS2 MolecularWeight: 361.456843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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