2-(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-chloranyl-4-nitro-phenyl)ethanamide

Systemtic Name: 2-(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-chloranyl-4-nitro-phenyl)ethanamide Openeye Name: 2-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-chloro-4-nitro-phenyl)acetamide CAS Name: 2-[(4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(2-chloro-4-nitrophenyl)acetamide IUPAC Name: 2-(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-chloro-4-nitrophenyl)acetamide Traditional Name: 2-[(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-chloro-4-nitro-phenyl)acetamide Formula: C16H14ClN5O3S2 MolecularWeight: 423.89706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C16H14ClN5O3S2/c1-7-8(2)27-15-13(7)14(18)20-16(21-15)26-6-12(23)19-11-4-3-9(22(24)25)5-10(11)17/h3-5H,6H2,1-2H3,(H,19,23)(H2,18,20,21)