1-(1,3-benzodioxol-5-yl)-N-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]methanamine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]methanamine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[[5-(2-thienyl)-1H-pyrazol-4-yl]methyl]methanamine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]methanamine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]methanamine Traditional Name: piperonyl-[[5-(2-thienyl)-1H-pyrazol-4-yl]methyl]amine Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC3=C(NN=C3)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC3=C(NN=C3)C4=CC=CS4

InChI

InChI=1S/C16H15N3O2S/c1-2-15(22-5-1)16-12(9-18-19-16)8-17-7-11-3-4-13-14(6-11)21-10-20-13/h1-6,9,17H,7-8,10H2,(H,18,19)