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

Systemtic Name: 1-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-3-tert-butyl-thiourea Openeye Name: 1-[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-3-tert-butyl-thiourea CAS Name: 1-tert-butyl-3-[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]thiourea Traditional Name: 1-[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]-3-tert-butyl-thiourea Formula: C17H20N4O3S MolecularWeight: 360.4307

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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)CC=C

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O3S/c1-5-8-21-14(23)11-7-6-10(9-12(11)15(21)24)13(22)19-20-16(25)18-17(2,3)4/h5-7,9H,1,8H2,2-4H3,(H,19,22)(H2,18,20,25)