N-(2-chloranyl-5-nitro-phenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]propionamide Formula: C17H15ClN4O3S2 MolecularWeight: 422.909

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C17H15ClN4O3S2/c1-8-9(2)26-16-14(8)17(20-7-19-16)27-10(3)15(23)21-13-6-11(22(24)25)4-5-12(13)18/h4-7,10H,1-3H3,(H,21,23)