N-(2-acetamidoethyl)-4-[(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-4-[(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-(2-acetamidoethyl)-4-[(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-(2-acetamidoethyl)-4-[(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(2-acetamidoethyl)-4-[(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-(2-acetamidoethyl)-4-[(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexanecarboxamide Formula: C18H24N4O3S2 MolecularWeight: 408.53816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1CCC(CC1)CN2C(=O)C3=C(C=CS3)NC2=S

Isomeric SMILES

CC(=O)NCCNC(=O)C1CCC(CC1)CN2C(=O)C3=C(C=CS3)NC2=S

InChI

InChI=1S/C18H24N4O3S2/c1-11(23)19-7-8-20-16(24)13-4-2-12(3-5-13)10-22-17(25)15-14(6-9-27-15)21-18(22)26/h6,9,12-13H,2-5,7-8,10H2,1H3,(H,19,23)(H,20,24)(H,21,26)