(3-cyclopropyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)methyl-ethyl-azanium

Systemtic Name: (3-cyclopropyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)methyl-ethyl-azanium Openeye Name: (3-cyclopropyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)methyl-ethyl-ammonium CAS Name: (3-cyclopropyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)methyl-ethylammonium IUPAC Name: (3-cyclopropyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)methyl-ethylazanium Traditional Name: (3-cyclopropyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)methyl-ethyl-ammonium Formula: C18H20N3OS+ MolecularWeight: 326.4359

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C4CC4

Isomeric SMILES

CC[NH2+]CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C4CC4

InChI

InChI=1S/C18H19N3OS/c1-2-19-10-15-20-17-16(18(22)21(15)13-8-9-13)14(11-23-17)12-6-4-3-5-7-12/h3-7,11,13,19H,2,8-10H2,1H3/p+1