1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)urea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)urea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-morpholino-1,3-benzothiazol-6-yl)urea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]urea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)urea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-morpholino-1,3-benzothiazol-6-yl)urea Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)NCC4COC5=CC=CC=C5O4

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)NCC4COC5=CC=CC=C5O4

InChI

InChI=1S/C21H22N4O4S/c26-20(22-12-15-13-28-17-3-1-2-4-18(17)29-15)23-14-5-6-16-19(11-14)30-21(24-16)25-7-9-27-10-8-25/h1-6,11,15H,7-10,12-13H2,(H2,22,23,26)