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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-6-methyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-6-methyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-imidazolyl)-6-methyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-6-methylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (2-imidazol-1-yl-6-methyl-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=CC2=C(N=C(N=C2S1)N3C=CN=C3)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC2=C(N=C(N=C2S1)N3C=CN=C3)NCC4=CC5=C(C=C4)OCO5

InChI

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