tert-butyl-[[4-(tert-butylamino)-6-ethoxycarbonyl-thieno[2,3-d]pyrimidin-5-yl]methyl]azanium

Systemtic Name: tert-butyl-[[4-(tert-butylamino)-6-ethoxycarbonyl-thieno[2,3-d]pyrimidin-5-yl]methyl]azanium Openeye Name: tert-butyl-[[4-(tert-butylamino)-6-ethoxycarbonyl-thieno[2,3-d]pyrimidin-5-yl]methyl]ammonium CAS Name: tert-butyl-[[4-(tert-butylamino)-6-ethoxycarbonyl-5-thieno[2,3-d]pyrimidinyl]methyl]ammonium IUPAC Name: tert-butyl-[[4-(tert-butylamino)-6-ethoxycarbonylthieno[2,3-d]pyrimidin-5-yl]methyl]azanium Traditional Name: tert-butyl-[[4-(tert-butylamino)-6-carbethoxy-thieno[2,3-d]pyrimidin-5-yl]methyl]ammonium Formula: C18H29N4O2S+ MolecularWeight: 365.51346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC(C)(C)C)C[NH2+]C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC(C)(C)C)C[NH2+]C(C)(C)C

InChI

InChI=1S/C18H28N4O2S/c1-8-24-16(23)13-11(9-21-17(2,3)4)12-14(22-18(5,6)7)19-10-20-15(12)25-13/h10,21H,8-9H2,1-7H3,(H,19,20,22)/p+1