1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(4-phenyldiazenylphenyl)thiourea

Systemtic Name: 1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(4-phenyldiazenylphenyl)thiourea Openeye Name: 1-(1,3-dioxoisoindolin-2-yl)-3-(4-phenylazophenyl)thiourea CAS Name: 1-(1,3-dioxo-2-isoindolyl)-3-(4-phenyldiazenylphenyl)thiourea IUPAC Name: 1-(1,3-dioxoisoindol-2-yl)-3-(4-phenyldiazenylphenyl)thiourea Traditional Name: 1-(4-phenylazophenyl)-3-phthalimido-thiourea Formula: C21H15N5O2S MolecularWeight: 401.4411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=S)NN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=S)NN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H15N5O2S/c27-19-17-8-4-5-9-18(17)20(28)26(19)25-21(29)22-14-10-12-16(13-11-14)24-23-15-6-2-1-3-7-15/h1-13H,(H2,22,25,29)