N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3=CC4=C(S3)C5=CC=CC=C5CC4

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3=CC4=C(S3)C5=CC=CC=C5CC4

InChI

InChI=1S/C21H17N3O2S2/c1-2-14-10-16-20(27-14)22-11-24(21(16)26)23-19(25)17-9-13-8-7-12-5-3-4-6-15(12)18(13)28-17/h3-6,9-11H,2,7-8H2,1H3,(H,23,25)