5-[2-[(4-iodanyl-3-nitro-phenyl)amino]pyrimidin-4-yl]-4-methyl-1,3-thiazol-2-amine

Systemtic Name: 5-[2-[(4-iodanyl-3-nitro-phenyl)amino]pyrimidin-4-yl]-4-methyl-1,3-thiazol-2-amine Openeye Name: 5-[2-(4-iodo-3-nitro-anilino)pyrimidin-4-yl]-4-methyl-thiazol-2-amine CAS Name: 5-[2-(4-iodo-3-nitroanilino)-4-pyrimidinyl]-4-methyl-2-thiazolamine IUPAC Name: 5-[2-(4-iodo-3-nitroanilino)pyrimidin-4-yl]-4-methyl-1,3-thiazol-2-amine Traditional Name: [4-(2-amino-4-methyl-thiazol-5-yl)pyrimidin-2-yl]-(4-iodo-3-nitro-phenyl)amine Formula: C14H11IN6O2S MolecularWeight: 454.24561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)C2=NC(=NC=C2)NC3=CC(=C(C=C3)I)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)N)C2=NC(=NC=C2)NC3=CC(=C(C=C3)I)[N+](=O)[O-]

InChI

InChI=1S/C14H11IN6O2S/c1-7-12(24-13(16)18-7)10-4-5-17-14(20-10)19-8-2-3-9(15)11(6-8)21(22)23/h2-6H,1H3,(H2,16,18)(H,17,19,20)