2-chloranyl-N-[4-methyl-5-[2-[(3-nitrophenyl)amino]pyrimidin-4-yl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-chloranyl-N-[4-methyl-5-[2-[(3-nitrophenyl)amino]pyrimidin-4-yl]-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-chloro-N-[4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]thiazol-2-yl]acetamide CAS Name: 2-chloro-N-[4-methyl-5-[2-(3-nitroanilino)-4-pyrimidinyl]-2-thiazolyl]acetamide IUPAC Name: 2-chloro-N-[4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]-1,3-thiazol-2-yl]acetamide Traditional Name: 2-chloro-N-[4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]thiazol-2-yl]acetamide Formula: C16H13ClN6O3S MolecularWeight: 404.83082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN6O3S/c1-9-14(27-16(19-9)22-13(24)8-17)12-5-6-18-15(21-12)20-10-3-2-4-11(7-10)23(25)26/h2-7H,8H2,1H3,(H,18,20,21)(H,19,22,24)