(3-cyclopropyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)methyl-pentyl-azanium

Systemtic Name: (3-cyclopropyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)methyl-pentyl-azanium Openeye Name: (3-cyclopropyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)methyl-pentyl-ammonium CAS Name: (3-cyclopropyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)methyl-pentylammonium IUPAC Name: (3-cyclopropyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)methyl-pentylazanium Traditional Name: amyl-[(3-cyclopropyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium Formula: C17H26N3OS+ MolecularWeight: 320.47284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]CC1=NC2=C(C(=C(S2)C)C)C(=O)N1C3CC3

Isomeric SMILES

CCCCC[NH2+]CC1=NC2=C(C(=C(S2)C)C)C(=O)N1C3CC3

InChI

InChI=1S/C17H25N3OS/c1-4-5-6-9-18-10-14-19-16-15(11(2)12(3)22-16)17(21)20(14)13-7-8-13/h13,18H,4-10H2,1-3H3/p+1