N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-thiophen-2-yl-pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-thiophen-2-yl-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-(2-thienyl)pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-thiophen-2-yl-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-thiophen-2-ylpyrimidin-4-amine Traditional Name: [2-methyl-5-(2-thienyl)pyrimidin-4-yl]-piperonyl-amine Formula: C17H15N3O2S MolecularWeight: 325.3849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)NCC2=CC3=C(C=C2)OCO3)C4=CC=CS4

Isomeric SMILES

CC1=NC=C(C(=N1)NCC2=CC3=C(C=C2)OCO3)C4=CC=CS4

InChI

InChI=1S/C17H15N3O2S/c1-11-18-9-13(16-3-2-6-23-16)17(20-11)19-8-12-4-5-14-15(7-12)22-10-21-14/h2-7,9H,8,10H2,1H3,(H,18,19,20)