N,N-bis(2-methoxyethyl)-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N,N-bis(2-methoxyethyl)-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N,N-bis(2-methoxyethyl)-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N,N-bis(2-methoxyethyl)-2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N,N-bis(2-methoxyethyl)-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: bis(2-methoxyethyl)-[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C21H29N4O3S2+ MolecularWeight: 449.60996

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=C2C(=CSC2=NC(=N1)C[NH+]3CCOCC3)C4=CC=CS4

Isomeric SMILES

COCCN(CCOC)C1=C2C(=CSC2=NC(=N1)C[NH+]3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C21H28N4O3S2/c1-26-9-7-25(8-10-27-2)20-19-16(17-4-3-13-29-17)15-30-21(19)23-18(22-20)14-24-5-11-28-12-6-24/h3-4,13,15H,5-12,14H2,1-2H3/p+1