1-[(4-dimethylaminophenyl)methyl]-3-(3-fluoranyl-4-methyl-phenyl)-1-methyl-thiourea

Systemtic Name: 1-[(4-dimethylaminophenyl)methyl]-3-(3-fluoranyl-4-methyl-phenyl)-1-methyl-thiourea Openeye Name: 1-[(4-dimethylaminophenyl)methyl]-3-(3-fluoro-4-methyl-phenyl)-1-methyl-thiourea CAS Name: 1-[(4-dimethylaminophenyl)methyl]-3-(3-fluoro-4-methylphenyl)-1-methylthiourea IUPAC Name: 1-[(4-dimethylaminophenyl)methyl]-3-(3-fluoro-4-methylphenyl)-1-methylthiourea Traditional Name: 1-[4-(dimethylamino)benzyl]-3-(3-fluoro-4-methyl-phenyl)-1-methyl-thiourea Formula: C18H22FN3S MolecularWeight: 331.450783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=CC=C(C=C2)N(C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=CC=C(C=C2)N(C)C)F

InChI

InChI=1S/C18H22FN3S/c1-13-5-8-15(11-17(13)19)20-18(23)22(4)12-14-6-9-16(10-7-14)21(2)3/h5-11H,12H2,1-4H3,(H,20,23)