2-(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]ethanamide

Systemtic Name: 2-(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]ethanamide Openeye Name: 2-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]acetamide CAS Name: 2-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)-N-[(1-propyl-4-piperidin-1-iumylidene)amino]acetamide IUPAC Name: 2-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]acetamide Traditional Name: 2-(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]acetamide Formula: C18H26N5O2S+ MolecularWeight: 376.49634

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(=NNC(=O)CC2=NC3=C(C(=C(S3)C)C)C(=O)N2)CC1

Isomeric SMILES

CCC[NH+]1CCC(=NNC(=O)CC2=NC3=C(C(=C(S3)C)C)C(=O)N2)CC1

InChI

InChI=1S/C18H25N5O2S/c1-4-7-23-8-5-13(6-9-23)21-22-15(24)10-14-19-17(25)16-11(2)12(3)26-18(16)20-14/h4-10H2,1-3H3,(H,22,24)(H,19,20,25)/p+1