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

Systemtic Name: 2-(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-[(4-nitrophenyl)carbamoyl]ethanamide Openeye Name: 2-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-[(4-nitrophenyl)carbamoyl]acetamide CAS Name: 2-[(4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-[(4-nitroanilino)-oxomethyl]acetamide IUPAC Name: 2-(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-[(4-nitrophenyl)carbamoyl]acetamide Traditional Name: 2-[(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-[(4-nitrophenyl)carbamoyl]acetamide Formula: C17H16N6O4S2 MolecularWeight: 432.47674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N6O4S2/c1-8-9(2)29-15-13(8)14(18)21-17(22-15)28-7-12(24)20-16(25)19-10-3-5-11(6-4-10)23(26)27/h3-6H,7H2,1-2H3,(H2,18,21,22)(H2,19,20,24,25)