1-[2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoylamino]-3-tert-butyl-thiourea

Systemtic Name: 1-[2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoylamino]-3-tert-butyl-thiourea Openeye Name: 1-tert-butyl-3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)acetyl]amino]thiourea CAS Name: 1-tert-butyl-3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)acetyl]amino]thiourea Traditional Name: 1-tert-butyl-3-[[2-(1,3-diketo-4H-isoquinolin-2-yl)acetyl]amino]thiourea Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)CN1C(=O)CC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)CN1C(=O)CC2=CC=CC=C2C1=O

InChI

InChI=1S/C16H20N4O3S/c1-16(2,3)17-15(24)19-18-12(21)9-20-13(22)8-10-6-4-5-7-11(10)14(20)23/h4-7H,8-9H2,1-3H3,(H,18,21)(H2,17,19,24)