1-(3-fluoranyl-4-methyl-phenyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-3-(2-morpholino-1,3-benzothiazol-6-yl)thiourea CAS Name: 1-(3-fluoro-4-methylphenyl)-3-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]thiourea IUPAC Name: 1-(3-fluoro-4-methylphenyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-3-(2-morpholino-1,3-benzothiazol-6-yl)thiourea Formula: C19H19FN4OS2 MolecularWeight: 402.508763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)F

InChI

InChI=1S/C19H19FN4OS2/c1-12-2-3-13(10-15(12)20)21-18(26)22-14-4-5-16-17(11-14)27-19(23-16)24-6-8-25-9-7-24/h2-5,10-11H,6-9H2,1H3,(H2,21,22,26)