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4-(1,3-benzodioxol-5-ylmethylamino)-1H-quinazoline-2-thione

4-(1,3-benzodioxol-5-ylmethylamino)-1H-quinazoline-2-thione

Systemtic Name:4-(1,3-benzodioxol-5-ylmethylamino)-1H-quinazoline-2-thione
Openeye Name:4-(1,3-benzodioxol-5-ylmethylamino)-1H-quinazoline-2-thione
CAS Name:4-(1,3-benzodioxol-5-ylmethylamino)-1H-quinazoline-2-thione
IUPAC Name:4-(1,3-benzodioxol-5-ylmethylamino)-1H-quinazoline-2-thione
Traditional Name:4-(piperonylamino)-1H-quinazoline-2-thione
Formula: C16H13N3O2S
MolecularWeight: 311.35832
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=S)NC4=CC=CC=C43


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=S)NC4=CC=CC=C43


InChI

InChI=1S/C16H13N3O2S/c22-16-18-12-4-2-1-3-11(12)15(19-16)17-8-10-5-6-13-14(7-10)21-9-20-13/h1-7H,8-9H2,(H2,17,18,19,22)


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