N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-morpholin-4-ylethylcarbamothioylamino)benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-morpholin-4-ylethylcarbamothioylamino)benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-morpholinoethylcarbamothioylamino)benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[[2-(4-morpholinyl)ethylamino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-morpholin-4-ylethylcarbamothioylamino)benzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-morpholinoethylthiocarbamoylamino)benzamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=S)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1COCCN1CCNC(=S)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H26N4O4S/c27-21(24-16-5-6-19-20(15-16)30-14-13-29-19)17-3-1-2-4-18(17)25-22(31)23-7-8-26-9-11-28-12-10-26/h1-6,15H,7-14H2,(H,24,27)(H2,23,25,31)