1-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-p-cumenyl-3-(3-phthalimidopropanoylamino)thiourea Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22N4O3S/c1-13(2)14-7-9-15(10-8-14)22-21(29)24-23-18(26)11-12-25-19(27)16-5-3-4-6-17(16)20(25)28/h3-10,13H,11-12H2,1-2H3,(H,23,26)(H2,22,24,29)