N-(6-chloranyl-5-nitro-pyrimidin-4-yl)-4-methyl-1,3-benzothiazol-2-amine

Systemtic Name: N-(6-chloranyl-5-nitro-pyrimidin-4-yl)-4-methyl-1,3-benzothiazol-2-amine Openeye Name: N-(6-chloro-5-nitro-pyrimidin-4-yl)-4-methyl-1,3-benzothiazol-2-amine CAS Name: N-(6-chloro-5-nitro-4-pyrimidinyl)-4-methyl-1,3-benzothiazol-2-amine IUPAC Name: N-(6-chloro-5-nitropyrimidin-4-yl)-4-methyl-1,3-benzothiazol-2-amine Traditional Name: (6-chloro-5-nitro-pyrimidin-4-yl)-(4-methyl-1,3-benzothiazol-2-yl)amine Formula: C12H8ClN5O2S MolecularWeight: 321.74222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H8ClN5O2S/c1-6-3-2-4-7-8(6)16-12(21-7)17-11-9(18(19)20)10(13)14-5-15-11/h2-5H,1H3,(H,14,15,16,17)