2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl-(thiophen-2-ylmethyl)amino]ethanol

Systemtic Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl-(thiophen-2-ylmethyl)amino]ethanol Openeye Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl-(2-thienylmethyl)amino]ethanol CAS Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-4-pyrazolyl]methyl-(thiophen-2-ylmethyl)amino]ethanol IUPAC Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methylpyrazol-4-yl]methyl-(thiophen-2-ylmethyl)amino]ethanol Traditional Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl-(2-thenyl)amino]ethanol Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCO3)CN(CCO)CC4=CC=CS4

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCO3)CN(CCO)CC4=CC=CS4

InChI

InChI=1S/C20H23N3O3S/c1-22-12-16(13-23(6-7-24)14-17-3-2-10-27-17)20(21-22)15-4-5-18-19(11-15)26-9-8-25-18/h2-5,10-12,24H,6-9,13-14H2,1H3