N-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6-dimethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6-dimethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6-dimethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6-dimethyl-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6-dimethyl-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (5,6-dimethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)-homopiperonyl-amine Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCCC3=CC4=C(C=C3)OCO4)N5C=CC=N5)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCCC3=CC4=C(C=C3)OCO4)N5C=CC=N5)C

InChI

InChI=1S/C20H19N5O2S/c1-12-13(2)28-19-17(12)18(23-20(24-19)25-9-3-7-22-25)21-8-6-14-4-5-15-16(10-14)27-11-26-15/h3-5,7,9-10H,6,8,11H2,1-2H3,(H,21,23,24)