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

Systemtic Name: 1-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-[2-(3-methylphenyl)ethyl]thiourea Openeye Name: 1-(4-fluoro-1,3-benzothiazol-2-yl)-3-[2-(m-tolyl)ethyl]thiourea CAS Name: 1-(4-fluoro-1,3-benzothiazol-2-yl)-3-[2-(3-methylphenyl)ethyl]thiourea IUPAC Name: 1-(4-fluoro-1,3-benzothiazol-2-yl)-3-[2-(3-methylphenyl)ethyl]thiourea Traditional Name: 1-(4-fluoro-1,3-benzothiazol-2-yl)-3-[2-(m-tolyl)ethyl]thiourea Formula: C17H16FN3S2 MolecularWeight: 345.457443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCNC(=S)NC2=NC3=C(C=CC=C3S2)F

Isomeric SMILES

CC1=CC(=CC=C1)CCNC(=S)NC2=NC3=C(C=CC=C3S2)F

InChI

InChI=1S/C17H16FN3S2/c1-11-4-2-5-12(10-11)8-9-19-16(22)21-17-20-15-13(18)6-3-7-14(15)23-17/h2-7,10H,8-9H2,1H3,(H2,19,20,21,22)