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

Systemtic Name: 1-[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]-1-methyl-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(3-fluoro-4-methyl-phenyl)carbamothioylamino]-1-methyl-thiourea CAS Name: 1-[[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]amino]-1-methyl-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(3-fluoro-4-methylphenyl)carbamothioylamino]-1-methylthiourea Traditional Name: 3-benzyl-1-[(3-fluoro-4-methyl-phenyl)thiocarbamoylamino]-1-methyl-thiourea Formula: C17H19FN4S2 MolecularWeight: 362.487963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NN(C)C(=S)NCC2=CC=CC=C2)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NN(C)C(=S)NCC2=CC=CC=C2)F

InChI

InChI=1S/C17H19FN4S2/c1-12-8-9-14(10-15(12)18)20-16(23)21-22(2)17(24)19-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,19,24)(H2,20,21,23)