1-[[4-azanyl-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,3,5-triazin-2-yl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-[[4-azanyl-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,3,5-triazin-2-yl]methyl]piperidine-4-carboxamide Openeye Name: 1-[[4-amino-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,3,5-triazin-2-yl]methyl]piperidine-4-carboxamide CAS Name: 1-[[4-amino-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,3,5-triazin-2-yl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[[4-amino-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,3,5-triazin-2-yl]methyl]piperidine-4-carboxamide Traditional Name: 1-[[4-amino-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-s-triazin-2-yl]methyl]isonipecotamide Formula: C18H23N7O3 MolecularWeight: 385.42032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CC2=NC(=NC(=N2)NC3=CC4=C(C=C3)OCCO4)N

Isomeric SMILES

C1CN(CCC1C(=O)N)CC2=NC(=NC(=N2)NC3=CC4=C(C=C3)OCCO4)N

InChI

InChI=1S/C18H23N7O3/c19-16(26)11-3-5-25(6-4-11)10-15-22-17(20)24-18(23-15)21-12-1-2-13-14(9-12)28-8-7-27-13/h1-2,9,11H,3-8,10H2,(H2,19,26)(H3,20,21,22,23,24)