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

Systemtic Name: 1-[4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propylsulfanyl]phenyl]-3-phenyl-thiourea Openeye Name: 1-[4-[3-(1,3-dioxoisoindolin-2-yl)propylsulfanyl]phenyl]-3-phenyl-thiourea CAS Name: 1-[4-[3-(1,3-dioxo-2-isoindolyl)propylthio]phenyl]-3-phenylthiourea IUPAC Name: 1-[4-[3-(1,3-dioxoisoindol-2-yl)propylsulfanyl]phenyl]-3-phenylthiourea Traditional Name: 1-phenyl-3-[4-(3-phthalimidopropylthio)phenyl]thiourea Formula: C24H21N3O2S2 MolecularWeight: 447.57244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H21N3O2S2/c28-22-20-9-4-5-10-21(20)23(29)27(22)15-6-16-31-19-13-11-18(12-14-19)26-24(30)25-17-7-2-1-3-8-17/h1-5,7-14H,6,15-16H2,(H2,25,26,30)