N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (5-methyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)-piperonyl-amine Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=NC(=NC(=C12)NCC3=CC4=C(C=C3)OCO4)N5C=CC=N5

Isomeric SMILES

CC1=CSC2=NC(=NC(=C12)NCC3=CC4=C(C=C3)OCO4)N5C=CC=N5

InChI

InChI=1S/C18H15N5O2S/c1-11-9-26-17-15(11)16(21-18(22-17)23-6-2-5-20-23)19-8-12-3-4-13-14(7-12)25-10-24-13/h2-7,9H,8,10H2,1H3,(H,19,21,22)