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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-6-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-6-methyl-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-6-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-[6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C21H17N3O2S/c1-12-3-5-14(6-4-12)18-13(2)27-21-19(18)20(22-10-23-21)24-15-7-8-16-17(9-15)26-11-25-16/h3-10H,11H2,1-2H3,(H,22,23,24)