1-[[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-[[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]-3-(4-fluorophenyl)thiourea Openeye Name: 1-[[4-(3,4-dimethylphenyl)-4-oxo-butanoyl]amino]-3-(4-fluorophenyl)thiourea CAS Name: 1-[[4-(3,4-dimethylphenyl)-1,4-dioxobutyl]amino]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[[4-(3,4-dimethylphenyl)-4-oxobutanoyl]amino]-3-(4-fluorophenyl)thiourea Traditional Name: 1-[[4-(3,4-dimethylphenyl)-4-keto-butanoyl]amino]-3-(4-fluorophenyl)thiourea Formula: C19H20FN3O2S MolecularWeight: 373.444403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)NNC(=S)NC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)NNC(=S)NC2=CC=C(C=C2)F)C

InChI

InChI=1S/C19H20FN3O2S/c1-12-3-4-14(11-13(12)2)17(24)9-10-18(25)22-23-19(26)21-16-7-5-15(20)6-8-16/h3-8,11H,9-10H2,1-2H3,(H,22,25)(H2,21,23,26)