2-[[5-(2-methoxy-5-methyl-phenyl)-3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium

Systemtic Name: 2-[[5-(2-methoxy-5-methyl-phenyl)-3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium Openeye Name: 2-[[5-(2-methoxy-5-methyl-phenyl)-3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]amino]ethylammonium CAS Name: 2-[[5-(2-methoxy-5-methylphenyl)-3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]amino]ethylammonium IUPAC Name: 2-[[5-(2-methoxy-5-methylphenyl)-3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium Traditional Name: 2-[[4-keto-5-(2-methoxy-5-methyl-phenyl)-3-methyl-thieno[2,3-d]pyrimidin-2-yl]amino]ethylammonium Formula: C17H21N4O2S+ MolecularWeight: 345.43924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=CSC3=C2C(=O)N(C(=N3)NCC[NH3+])C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=CSC3=C2C(=O)N(C(=N3)NCC[NH3+])C

InChI

InChI=1S/C17H20N4O2S/c1-10-4-5-13(23-3)11(8-10)12-9-24-15-14(12)16(22)21(2)17(20-15)19-7-6-18/h4-5,8-9H,6-7,18H2,1-3H3,(H,19,20)/p+1