N-ethyl-4-[(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-ethyl-4-[(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazine-1-carbothioamide Openeye Name: N-ethyl-4-[[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]piperazine-1-carbothioamide CAS Name: N-ethyl-4-[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-ethyl-4-[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazine-1-carbothioamide Traditional Name: N-ethyl-4-[[4-keto-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]piperazine-1-carbothioamide Formula: C18H21N5OS3 MolecularWeight: 419.58724

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCN(CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

Isomeric SMILES

CCNC(=S)N1CCN(CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

InChI

InChI=1S/C18H21N5OS3/c1-2-19-18(25)23-7-5-22(6-8-23)10-14-20-16(24)15-12(11-27-17(15)21-14)13-4-3-9-26-13/h3-4,9,11H,2,5-8,10H2,1H3,(H,19,25)(H,20,21,24)