4-methyl-5-[2-[(3-nitrophenyl)amino]pyrimidin-4-yl]-1,3-thiazol-2-amine hydrochloride

Systemtic Name: 4-methyl-5-[2-[(3-nitrophenyl)amino]pyrimidin-4-yl]-1,3-thiazol-2-amine hydrochloride Openeye Name: 4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]thiazol-2-amine hydrochloride CAS Name: 4-methyl-5-[2-(3-nitroanilino)-4-pyrimidinyl]-2-thiazolamine hydrochloride IUPAC Name: 4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]-1,3-thiazol-2-amine hydrochloride Traditional Name: [4-(2-amino-4-methyl-thiazol-5-yl)pyrimidin-2-yl]-(3-nitrophenyl)amine hydrochloride Formula: C14H13ClN6O2S MolecularWeight: 364.81002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N6O2S.ClH/c1-8-12(23-13(15)17-8)11-5-6-16-14(19-11)18-9-3-2-4-10(7-9)20(21)22;/h2-7H,1H3,(H2,15,17)(H,16,18,19);1H