1-[(3,4-dimethylphenyl)carbonylamino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[(3,4-dimethylphenyl)carbonylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(3,4-dimethylbenzoyl)amino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[[(3,4-dimethylphenyl)-oxomethyl]amino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(3,4-dimethylbenzoyl)amino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[(3,4-dimethylbenzoyl)amino]-3-(4-fluorobenzyl)thiourea Formula: C17H18FN3OS MolecularWeight: 331.407723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C17H18FN3OS/c1-11-3-6-14(9-12(11)2)16(22)20-21-17(23)19-10-13-4-7-15(18)8-5-13/h3-9H,10H2,1-2H3,(H,20,22)(H2,19,21,23)