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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-chloranyl-6-methyl-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-6-methyl-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-6-methyl-2-(2-pyrazinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-6-methyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (5-chloro-6-methyl-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-yl)-piperonyl-amine Formula: C19H14ClN5O2S MolecularWeight: 411.86476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=C(N=C2S1)C3=NC=CN=C3)NCC4=CC5=C(C=C4)OCO5)Cl

Isomeric SMILES

CC1=C(C2=C(N=C(N=C2S1)C3=NC=CN=C3)NCC4=CC5=C(C=C4)OCO5)Cl

InChI

InChI=1S/C19H14ClN5O2S/c1-10-16(20)15-18(23-7-11-2-3-13-14(6-11)27-9-26-13)24-17(25-19(15)28-10)12-8-21-4-5-22-12/h2-6,8H,7,9H2,1H3,(H,23,24,25)