1-[(E)-2-[8-bromanyl-3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethylideneamino]thiourea

Systemtic Name: 1-[(E)-2-[8-bromanyl-3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethylideneamino]thiourea Openeye Name: [(E)-2-(8-bromo-3-methyl-2,6-dioxo-purin-7-yl)ethylideneamino]thiourea CAS Name: [(E)-2-(8-bromo-3-methyl-2,6-dioxo-7-purinyl)ethylideneamino]thiourea IUPAC Name: [(E)-2-(8-bromo-3-methyl-2,6-dioxopurin-7-yl)ethylideneamino]thiourea Traditional Name: [(E)-2-(8-bromo-2,6-diketo-3-methyl-purin-7-yl)ethylideneamino]thiourea Formula: C9H10BrN7O2S MolecularWeight: 360.1904

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CC=NNC(=S)N

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)C/C=N/NC(=S)N

InChI

InChI=1S/C9H10BrN7O2S/c1-16-5-4(6(18)14-9(16)19)17(7(10)13-5)3-2-12-15-8(11)20/h2H,3H2,1H3,(H3,11,15,20)(H,14,18,19)/b12-2+