1-(1,3-benzodioxol-5-yl)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(1,3-dioxoisoindolin-2-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(1,3-dioxo-2-isoindolyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(1,3-dioxoisoindol-2-yl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-phthalimido-thiourea Formula: C16H11N3O4S MolecularWeight: 341.34124

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C16H11N3O4S/c20-14-10-3-1-2-4-11(10)15(21)19(14)18-16(24)17-9-5-6-12-13(7-9)23-8-22-12/h1-7H,8H2,(H2,17,18,24)