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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-chloro-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)-piperonyl-amine Formula: C17H12ClN5O2S MolecularWeight: 385.82748

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C4C=C(SC4=NC(=N3)N5C=CC=N5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C4C=C(SC4=NC(=N3)N5C=CC=N5)Cl

InChI

InChI=1S/C17H12ClN5O2S/c18-14-7-11-15(19-8-10-2-3-12-13(6-10)25-9-24-12)21-17(22-16(11)26-14)23-5-1-4-20-23/h1-7H,8-9H2,(H,19,21,22)