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

Systemtic Name: 2-(morpholin-4-ium-4-ylmethyl)-N-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-allyl-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-(4-morpholin-4-iumylmethyl)-N-prop-2-enyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 2-(morpholin-4-ium-4-ylmethyl)-N-prop-2-enyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: allyl-[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C18H21N4OS2+ MolecularWeight: 373.51554

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=C2C(=CSC2=NC(=N1)C[NH+]3CCOCC3)C4=CC=CS4

Isomeric SMILES

C=CCNC1=C2C(=CSC2=NC(=N1)C[NH+]3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C18H20N4OS2/c1-2-5-19-17-16-13(14-4-3-10-24-14)12-25-18(16)21-15(20-17)11-22-6-8-23-9-7-22/h2-4,10,12H,1,5-9,11H2,(H,19,20,21)/p+1