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

Systemtic Name: 1-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoylamino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoylamino]-3-p-anisyl-thiourea Formula: C19H25N5O2S2 MolecularWeight: 419.5641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NNC(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NNC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H25N5O2S2/c1-12-16(13(2)22-19(21-12)28-4)9-10-17(25)23-24-18(27)20-11-14-5-7-15(26-3)8-6-14/h5-8H,9-11H2,1-4H3,(H,23,25)(H2,20,24,27)