1-(3-chloranyl-4-methyl-phenyl)-3-[(4,6-dimethylpyrimidin-2-yl)amino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(4,6-dimethylpyrimidin-2-yl)amino]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[(4,6-dimethylpyrimidin-2-yl)amino]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[(4,6-dimethyl-2-pyrimidinyl)amino]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[(4,6-dimethylpyrimidin-2-yl)amino]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[(4,6-dimethylpyrimidin-2-yl)amino]thiourea Formula: C14H16ClN5S MolecularWeight: 321.82834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC2=NC(=CC(=N2)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC2=NC(=CC(=N2)C)C)Cl

InChI

InChI=1S/C14H16ClN5S/c1-8-4-5-11(7-12(8)15)18-14(21)20-19-13-16-9(2)6-10(3)17-13/h4-7H,1-3H3,(H,16,17,19)(H2,18,20,21)