[5-(1,3-benzodioxol-5-ylmethylamino)-1-propyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [5-(1,3-benzodioxol-5-ylmethylamino)-1-propyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [5-(1,3-benzodioxol-5-ylmethylamino)-1-propyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone CAS Name: [5-(1,3-benzodioxol-5-ylmethylamino)-1-propyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone IUPAC Name: [5-(1,3-benzodioxol-5-ylmethylamino)-1-propyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [5-(piperonylamino)-1-propyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)NCC3=CC4=C(C=C3)OCO4)C(=N1)C(=O)N5CCSCC5

Isomeric SMILES

CCCN1C2=C(CC(CC2)NCC3=CC4=C(C=C3)OCO4)C(=N1)C(=O)N5CCSCC5

InChI

InChI=1S/C23H30N4O3S/c1-2-7-27-19-5-4-17(24-14-16-3-6-20-21(12-16)30-15-29-20)13-18(19)22(25-27)23(28)26-8-10-31-11-9-26/h3,6,12,17,24H,2,4-5,7-11,13-15H2,1H3