1-(2,4-dichlorophenyl)-3-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]thiourea

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]thiourea Openeye Name: 1-(2,4-dichlorophenyl)-3-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]thiourea CAS Name: 1-(2,4-dichlorophenyl)-3-[[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]amino]thiourea IUPAC Name: 1-(2,4-dichlorophenyl)-3-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoylamino]thiourea Traditional Name: 1-(2,4-dichlorophenyl)-3-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoylamino]thiourea Formula: C17H19Cl2N5OS2 MolecularWeight: 444.40166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NNC(=S)NC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NNC(=S)NC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H19Cl2N5OS2/c1-9-12(10(2)21-17(20-9)27-3)5-7-15(25)23-24-16(26)22-14-6-4-11(18)8-13(14)19/h4,6,8H,5,7H2,1-3H3,(H,23,25)(H2,22,24,26)