3-[[5-(3,4-dimethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium

Systemtic Name: 3-[[5-(3,4-dimethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Openeye Name: 3-[[5-(3,4-dimethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylammonium CAS Name: 3-[[5-(3,4-dimethoxyphenyl)-6-methyl-4-thieno[2,3-d]pyrimidinyl]amino]propylammonium IUPAC Name: 3-[[5-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Traditional Name: 3-[[5-(3,4-dimethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylammonium Formula: C18H23N4O2S+ MolecularWeight: 359.46582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NCCC[NH3+])C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NCCC[NH3+])C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C18H22N4O2S/c1-11-15(12-5-6-13(23-2)14(9-12)24-3)16-17(20-8-4-7-19)21-10-22-18(16)25-11/h5-6,9-10H,4,7-8,19H2,1-3H3,(H,20,21,22)/p+1