1-[[2,5-bis(chloranyl)-6-isocyano-pyrimidin-4-yl]amino]-3-(2-methoxy-5-methyl-phenyl)urea

Systemtic Name: 1-[[2,5-bis(chloranyl)-6-isocyano-pyrimidin-4-yl]amino]-3-(2-methoxy-5-methyl-phenyl)urea Openeye Name: 1-[(2,5-dichloro-6-isocyano-pyrimidin-4-yl)amino]-3-(2-methoxy-5-methyl-phenyl)urea CAS Name: 1-[(2,5-dichloro-6-isocyano-4-pyrimidinyl)amino]-3-(2-methoxy-5-methylphenyl)urea IUPAC Name: 1-[(2,5-dichloro-6-isocyanopyrimidin-4-yl)amino]-3-(2-methoxy-5-methylphenyl)urea Traditional Name: 1-[(2,5-dichloro-6-isocyano-pyrimidin-4-yl)amino]-3-(2-methoxy-5-methyl-phenyl)urea Formula: C14H12Cl2N6O2 MolecularWeight: 367.19008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)NNC2=NC(=NC(=C2Cl)[N+]#[C-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)NNC2=NC(=NC(=C2Cl)[N+]#[C-])Cl

InChI

InChI=1S/C14H12Cl2N6O2/c1-7-4-5-9(24-3)8(6-7)18-14(23)22-21-12-10(15)11(17-2)19-13(16)20-12/h4-6H,1,3H3,(H2,18,22,23)(H,19,20,21)