N-(3-chloranyl-4-methyl-phenyl)-2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-methylphenyl)-2-(4-morpholin-4-iumylmethyl)-5-phenyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(morpholin-4-ium-4-ylmethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-methyl-phenyl)-[2-(morpholin-4-ium-4-ylmethyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-yl]amine Formula: C24H24ClN4OS+ MolecularWeight: 451.99156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CC=C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C24H23ClN4OS/c1-16-7-8-18(13-20(16)25)26-23-22-19(17-5-3-2-4-6-17)15-31-24(22)28-21(27-23)14-29-9-11-30-12-10-29/h2-8,13,15H,9-12,14H2,1H3,(H,26,27,28)/p+1