N-(1-benzothiophen-2-ylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(1-benzothiophen-2-ylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(benzothiophen-2-ylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-triazole-4-carboxamide CAS Name: N-(1-benzothiophen-2-ylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-4-triazolecarboxamide IUPAC Name: N-(1-benzothiophen-2-ylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyltriazole-4-carboxamide Traditional Name: N-(benzothiophen-2-ylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-triazole-4-carboxamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=CC=CC=C2S1)C(=O)C3=CN(N=N3)CC4COC5=CC=CC=C5O4

Isomeric SMILES

CN(CC1=CC2=CC=CC=C2S1)C(=O)C3=CN(N=N3)CC4COC5=CC=CC=C5O4

InChI

InChI=1S/C22H20N4O3S/c1-25(12-17-10-15-6-2-5-9-21(15)30-17)22(27)18-13-26(24-23-18)11-16-14-28-19-7-3-4-8-20(19)29-16/h2-10,13,16H,11-12,14H2,1H3