1-(2-dimethylaminoethyl)-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-(2-dimethylaminoethyl)-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea Openeye Name: 1-(2-dimethylaminoethyl)-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea CAS Name: 1-(2-dimethylaminoethyl)-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-(2-dimethylaminoethyl)-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea Traditional Name: 1-(2-dimethylaminoethyl)-3-(4-fluorophenyl)-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C23H27FN4OS MolecularWeight: 426.550083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCN(C)C)C(=S)NC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCN(C)C)C(=S)NC3=CC=C(C=C3)F)C

InChI

InChI=1S/C23H27FN4OS/c1-15-11-16(2)20-13-17(22(29)26-21(20)12-15)14-28(10-9-27(3)4)23(30)25-19-7-5-18(24)6-8-19/h5-8,11-13H,9-10,14H2,1-4H3,(H,25,30)(H,26,29)