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

Systemtic Name: (3-cyclopropyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)methyl-hexyl-azanium Openeye Name: (3-cyclopropyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)methyl-hexyl-ammonium CAS Name: (3-cyclopropyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)methyl-hexylammonium IUPAC Name: (3-cyclopropyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)methyl-hexylazanium Traditional Name: (3-cyclopropyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl-hexyl-ammonium Formula: C18H28N3OS+ MolecularWeight: 334.49942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3OS/c1-4-5-6-7-10-19-11-15-20-17-16(12(2)13(3)23-17)18(22)21(15)14-8-9-14/h14,19H,4-11H2,1-3H3/p+1