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

Systemtic Name: 1-(3-ethanoylphenyl)-3-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)thiourea Openeye Name: 1-(3-acetylphenyl)-3-(4-morpholino-2,1,3-benzoxadiazol-7-yl)thiourea CAS Name: 1-(3-acetylphenyl)-3-[4-(4-morpholinyl)-2,1,3-benzoxadiazol-7-yl]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)thiourea Traditional Name: 1-(3-acetylphenyl)-3-(7-morpholinobenzofurazan-4-yl)thiourea Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C3=NON=C23)N4CCOCC4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C3=NON=C23)N4CCOCC4

InChI

InChI=1S/C19H19N5O3S/c1-12(25)13-3-2-4-14(11-13)20-19(28)21-15-5-6-16(18-17(15)22-27-23-18)24-7-9-26-10-8-24/h2-6,11H,7-10H2,1H3,(H2,20,21,28)