(2-nitrophenyl) 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: (2-nitrophenyl) 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: (2-nitrophenyl) 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinecarboxylic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylic acid (2-nitrophenyl) ester Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)OC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)OC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4S/c1-2-13-11-14-17(20-12-21-18(14)29-13)22-7-9-23(10-8-22)19(25)28-16-6-4-3-5-15(16)24(26)27/h3-6,11-12H,2,7-10H2,1H3