1-(1,3-benzodioxol-5-yl)-3-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(4-morpholino-2,1,3-benzoxadiazol-7-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(4-morpholinyl)-2,1,3-benzoxadiazol-7-yl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(7-morpholinobenzofurazan-4-yl)thiourea Formula: C18H17N5O4S MolecularWeight: 399.42368

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C3=NON=C23)NC(=S)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COCCN1C2=CC=C(C3=NON=C23)NC(=S)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C18H17N5O4S/c28-18(19-11-1-4-14-15(9-11)26-10-25-14)20-12-2-3-13(17-16(12)21-27-22-17)23-5-7-24-8-6-23/h1-4,9H,5-8,10H2,(H2,19,20,28)