N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-4-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-4-(4-thiazolylmethylthio)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-4-(thiazol-4-ylmethylthio)benzamide Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC=C(C=C3)SCC4=CSC=N4

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC=C(C=C3)SCC4=CSC=N4

InChI

InChI=1S/C22H22N2O3S2/c1-2-24(12-16-3-8-20-21(11-16)27-10-9-26-20)22(25)17-4-6-19(7-5-17)29-14-18-13-28-15-23-18/h3-8,11,13,15H,2,9-10,12,14H2,1H3