1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-methyl-thiourea

Systemtic Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-methyl-thiourea Openeye Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-methyl-thiourea CAS Name: 1-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]-3-methylthiourea IUPAC Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-methylthiourea Traditional Name: 1-[3-[(4-fluorophenyl)thio]propanoylamino]-3-methyl-thiourea Formula: C11H14FN3OS2 MolecularWeight: 287.376763

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)CCSC1=CC=C(C=C1)F

Isomeric SMILES

CNC(=S)NNC(=O)CCSC1=CC=C(C=C1)F

InChI

InChI=1S/C11H14FN3OS2/c1-13-11(17)15-14-10(16)6-7-18-9-4-2-8(12)3-5-9/h2-5H,6-7H2,1H3,(H,14,16)(H2,13,15,17)