2-(3-ethyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-[(4-nitrophenyl)carbamoyl]propanamide

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-[(4-nitrophenyl)carbamoyl]propanamide Openeye Name: 2-(3-ethyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-[(4-nitrophenyl)carbamoyl]propanamide CAS Name: 2-[(3-ethyl-4-oxo-2-thieno[3,2-d]pyrimidinyl)thio]-N-[(4-nitroanilino)-oxomethyl]propanamide IUPAC Name: 2-(3-ethyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-[(4-nitrophenyl)carbamoyl]propanamide Traditional Name: 2-[(3-ethyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]-N-[(4-nitrophenyl)carbamoyl]propionamide Formula: C18H17N5O5S2 MolecularWeight: 447.48808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CS2)N=C1SC(C)C(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=O)C2=C(C=CS2)N=C1SC(C)C(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O5S2/c1-3-22-16(25)14-13(8-9-29-14)20-18(22)30-10(2)15(24)21-17(26)19-11-4-6-12(7-5-11)23(27)28/h4-10H,3H2,1-2H3,(H2,19,21,24,26)