4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]amino]-N,N-diethyl-benzamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H24N2O4S/c1-3-23(4-2)21(25)15-5-7-16(8-6-15)22-20(24)14-28-17-9-10-18-19(13-17)27-12-11-26-18/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,22,24)