N-[2-[(2-nitrophenyl)amino]ethyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[2-[(2-nitrophenyl)amino]ethyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-[2-(2-nitroanilino)ethyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-[2-(2-nitroanilino)ethyl]-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-[2-(2-nitroanilino)ethyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-[2-(2-nitroanilino)ethyl]-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C16H15N5O3S2 MolecularWeight: 389.452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCCNC(=O)CSC2=NC=NC3=C2C=CS3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NCCNC(=O)CSC2=NC=NC3=C2C=CS3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O3S2/c22-14(9-26-16-11-5-8-25-15(11)19-10-20-16)18-7-6-17-12-3-1-2-4-13(12)21(23)24/h1-5,8,10,17H,6-7,9H2,(H,18,22)