dimethyl-[2-[(5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-yl)amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[(5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-yl)amino]ethyl]azanium Openeye Name: dimethyl-[2-[[5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[5-phenyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[(5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)amino]ethyl]azanium Traditional Name: dimethyl-[2-[[5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl]ammonium Formula: C21H22N5S+ MolecularWeight: 376.49788

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=C2C(=CSC2=NC(=N1)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)CCNC1=C2C(=CSC2=NC(=N1)C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5S/c1-26(2)12-11-23-20-18-17(15-7-4-3-5-8-15)14-27-21(18)25-19(24-20)16-9-6-10-22-13-16/h3-10,13-14H,11-12H2,1-2H3,(H,23,24,25)/p+1