phenyl 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanesulfonate

Systemtic Name: phenyl 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanesulfonate Openeye Name: phenyl 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanesulfonate CAS Name: 2-[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)thio]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanesulfonate Traditional Name: 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)thio]ethanesulfonic acid phenyl ester Formula: C16H16N2O3S3 MolecularWeight: 380.50484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN=C2SCCS(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CCC1=CC2=C(S1)N=CN=C2SCCS(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C16H16N2O3S3/c1-2-13-10-14-15(17-11-18-16(14)23-13)22-8-9-24(19,20)21-12-6-4-3-5-7-12/h3-7,10-11H,2,8-9H2,1H3