1-tert-butyl-3-[[2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[[2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[[2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]thiourea CAS Name: 1-tert-butyl-3-[[[2-(3-methoxypropyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[[2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carbonyl]amino]thiourea Traditional Name: 1-tert-butyl-3-[[1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carbonyl]amino]thiourea Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCCOC

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCCOC

InChI

InChI=1S/C18H24N4O4S/c1-18(2,3)19-17(27)21-20-14(23)11-6-7-12-13(10-11)16(25)22(15(12)24)8-5-9-26-4/h6-7,10H,5,8-9H2,1-4H3,(H,20,23)(H2,19,21,27)