7-(ethoxymethyl)-4-(ethylamino)pyrrolo[2,3-d]pyrimidine-5-carbothioamide

Systemtic Name: 7-(ethoxymethyl)-4-(ethylamino)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Openeye Name: 7-(ethoxymethyl)-4-(ethylamino)pyrrolo[2,3-d]pyrimidine-5-carbothioamide CAS Name: 7-(ethoxymethyl)-4-(ethylamino)-5-pyrrolo[2,3-d]pyrimidinecarbothioamide IUPAC Name: 7-(ethoxymethyl)-4-(ethylamino)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Traditional Name: 7-(ethoxymethyl)-4-(ethylamino)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Formula: C12H17N5OS MolecularWeight: 279.36128

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=NC2=C1C(=CN2COCC)C(=S)N

Isomeric SMILES

CCNC1=NC=NC2=C1C(=CN2COCC)C(=S)N

InChI

InChI=1S/C12H17N5OS/c1-3-14-11-9-8(10(13)19)5-17(7-18-4-2)12(9)16-6-15-11/h5-6H,3-4,7H2,1-2H3,(H2,13,19)(H,14,15,16)