1-(3,4-dimethylphenyl)-3-[2-(furan-2-ylmethylsulfanyl)ethyl]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[2-(furan-2-ylmethylsulfanyl)ethyl]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[2-(2-furylmethylsulfanyl)ethyl]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[2-(2-furanylmethylthio)ethyl]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[2-(furan-2-ylmethylsulfanyl)ethyl]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[2-(2-furfurylthio)ethyl]thiourea Formula: C16H20N2OS2 MolecularWeight: 320.4728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCSCC2=CC=CO2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCSCC2=CC=CO2)C

InChI

InChI=1S/C16H20N2OS2/c1-12-5-6-14(10-13(12)2)18-16(20)17-7-9-21-11-15-4-3-8-19-15/h3-6,8,10H,7,9,11H2,1-2H3,(H2,17,18,20)