1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-[4-(4-nitrophenyl)sulfanylphenyl]urea

Systemtic Name: 1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-[4-(4-nitrophenyl)sulfanylphenyl]urea Openeye Name: 1-(1,3-dioxoisoindolin-2-yl)-3-[4-(4-nitrophenyl)sulfanylphenyl]urea CAS Name: 1-(1,3-dioxo-2-isoindolyl)-3-[4-[(4-nitrophenyl)thio]phenyl]urea IUPAC Name: 1-(1,3-dioxoisoindol-2-yl)-3-[4-(4-nitrophenyl)sulfanylphenyl]urea Traditional Name: 1-[4-[(4-nitrophenyl)thio]phenyl]-3-phthalimido-urea Formula: C21H14N4O5S MolecularWeight: 434.42466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)NC(=O)NC3=CC=C(C=C3)SC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)NC(=O)NC3=CC=C(C=C3)SC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14N4O5S/c26-19-17-3-1-2-4-18(17)20(27)24(19)23-21(28)22-13-5-9-15(10-6-13)31-16-11-7-14(8-12-16)25(29)30/h1-12H,(H2,22,23,28)